CAS RN: 138483-63-3
CAS Name: N-[(2S,3S,5R)-3-hydroxy-6-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-5-[[4-[2-(4-morpholinyl)ethoxy]phenyl]methyl]-6-oxo-1-phenylhexan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S,2R)-2-hydroxyindan-1-yl]amino]-4-[[4-(2-morpholinoethoxy)phenyl]methyl]-5-oxo-pentyl]carbamate
IUPAC Name: tert-butyl N-[(2S,3S,5R)-3-hydroxy-6-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-5-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]-6-oxo-1-phenylhexan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2S,3S,5R)-5-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]-3-oxidanyl-6-[[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]amino]-6-oxidanylidene-1-phenyl-hexan-2-yl]carbamate
MOLECULAR FORMULA: C39H51N3O7
MOLECULAR WEIGHT: 673.83814
SMILES: CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@H](C[C@@H](CC2=CC=C(C=C2)OCCN3CCOCC3)C(=O)N[C@@H]4[C@@H](CC5=CC=CC=C45)O)O
Structure:
CAS RN: 126456-36-8
CAS Name: N-[(2S,3S,5R)-3-hydroxy-6-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-6-oxo-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[(1S,2S,4R)-1,4-dibenzyl-2-hydroxy-5-[[(1S,2R)-2-hydroxyindan-1-yl]amino]-5-oxo-pentyl]carbamate
IUPAC Name: tert-butyl N-[(2S,3S,5R)-5-benzyl-3-hydroxy-6-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-6-oxo-1-phenylhexan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2S,3S,5R)-3-oxidanyl-6-[[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]amino]-6-oxidanylidene-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamate
MOLECULAR FORMULA: C33H40N2O5
MOLECULAR WEIGHT: 544.6811
SMILES: CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@H](C[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H]3[C@@H](CC4=CC=CC=C34)O)O
Structure:
CAS RN: 125-72-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H29NO7
MOLECULAR WEIGHT: 407.45746
SMILES: CN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 2603-64-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H29NO7
MOLECULAR WEIGHT: 407.45746
SMILES: CN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 5497-47-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H29NO7
MOLECULAR WEIGHT: 407.45746
SMILES: CN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 5985-35-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H24BrNO
MOLECULAR WEIGHT: 338.28256
SMILES: CN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O.Br
Structure:
CAS RN: 125-69-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H26BrNO
MOLECULAR WEIGHT: 352.30914
SMILES: CN1CC[C@@]23CCCC[C@@H]2[C@@H]1CC4=C3C=C(C=C4)OC.Br
Structure:
CAS RN: 143394-68-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H29N5O
MOLECULAR WEIGHT: 367.48786
SMILES: CCCN1C2=C(C3=NC(CN3C1=O)CC)NC(=N2)C45CC6CC(C4)CC5C6
Structure:
CAS RN: 112851-89-5
CAS Name: (6E)-6-[(1-adamantylamino)methylidene]-4-hydroxy-1-cyclohexa-2,4-dienone
OPENEYE Name: (6E)-6-[(1-adamantylamino)methylene]-4-hydroxy-cyclohexa-2,4-dien-1-one
IUPAC Name: (6E)-6-[(1-adamantylamino)methylidene]-4-hydroxycyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6E)-6-[(1-adamantylamino)methylidene]-4-oxidanyl-cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C17H21NO2
MOLECULAR WEIGHT: 271.35414
SMILES: C1C2CC3CC1CC(C2)(C3)N/C=C/4\C=C(C=CC4=O)O
Structure:
CAS RN: 5934-69-0
CAS Name: (Z)-1-(1-adamantyl)-2-diazonioethenolate
OPENEYE Name: (Z)-1-(1-adamantyl)-2-diazonio-ethenolate
IUPAC Name: (Z)-1-(1-adamantyl)-2-diazonioethenolate
SYSTEMATIC NAME: (Z)-1-(1-adamantyl)-2-diazonio-ethenolate
MOLECULAR FORMULA: C12H16N2O
MOLECULAR WEIGHT: 204.26824
SMILES: C1C2CC3CC1CC(C2)(C3)/C(=C/[N+]#N)/[O-]
Structure:
CAS RN: 36933-79-6
CAS Name: 6-iodo-2-methyl-3-[4-[[(Z)-(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-4-quinazolinone
OPENEYE Name: 6-iodo-2-methyl-3-[4-[[(Z)-(5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
IUPAC Name: 6-iodo-2-methyl-3-[4-[[(Z)-(5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
SYSTEMATIC NAME: 6-iodanyl-2-methyl-3-[4-[[(Z)-(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
MOLECULAR FORMULA: C22H15IN4O4
MOLECULAR WEIGHT: 526.28337
SMILES: CC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=C(C=C3)N/C=C\4/C=CC=C(C4=O)[N+](=O)[O-]
Structure:
CAS RN: 106924-13-4
CAS Name: 6,8-dibromo-2-methyl-3-[[2-(4-oxo-1-cyclohexa-2,5-dienylidene)-3H-1,3,4-oxadiazol-5-yl]methyl]-4-quinazolinone
OPENEYE Name: 6,8-dibromo-2-methyl-3-[[2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]methyl]quinazolin-4-one
IUPAC Name: 6,8-dibromo-2-methyl-3-[[2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]methyl]quinazolin-4-one
SYSTEMATIC NAME: 6,8-bis(bromanyl)-2-methyl-3-[[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]methyl]quinazolin-4-one
MOLECULAR FORMULA: C18H12Br2N4O3
MOLECULAR WEIGHT: 492.12088
SMILES: CC1=NC2=C(C=C(C=C2C(=O)N1CC3=NNC(=C4C=CC(=O)C=C4)O3)Br)Br
Structure:
CAS RN: 78899-00-0
CAS Name: (2E)-3-(5-nitro-2-pyridinyl)-2-[2-(4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-1H-quinazolin-4-one
OPENEYE Name: (2E)-3-(5-nitro-2-pyridyl)-2-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one
IUPAC Name: (2E)-3-(5-nitropyridin-2-yl)-2-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-3-(5-nitropyridin-2-yl)-2-[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one
MOLECULAR FORMULA: C21H14N4O4
MOLECULAR WEIGHT: 386.36026
SMILES: C1=CC=C2C(=C1)C(=O)N(/C(=C/C=C3C=CC(=O)C=C3)/N2)C4=NC=C(C=C4)[N+](=O)[O-]
Structure:
CAS RN: 106924-06-5
CAS Name: 2-methyl-3-[[2-(4-oxo-1-cyclohexa-2,5-dienylidene)-3H-1,3,4-oxadiazol-5-yl]methyl]-4-quinazolinone
OPENEYE Name: 2-methyl-3-[[2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]methyl]quinazolin-4-one
IUPAC Name: 2-methyl-3-[[2-(4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]methyl]quinazolin-4-one
SYSTEMATIC NAME: 2-methyl-3-[[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]methyl]quinazolin-4-one
MOLECULAR FORMULA: C18H14N4O3
MOLECULAR WEIGHT: 334.32876
SMILES: CC1=NC2=CC=CC=C2C(=O)N1CC3=NNC(=C4C=CC(=O)C=C4)O3
Structure:
CAS RN: 85226-50-2
CAS Name: (2E)-6-iodo-2-[(2E)-2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-3-(2-methylanilino)-1H-quinazolin-4-one
OPENEYE Name: (2E)-6-iodo-2-[(2E)-2-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylidene]-3-(2-methylanilino)-1H-quinazolin-4-one
IUPAC Name: (2E)-6-iodo-2-[(2E)-2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-3-(2-methylanilino)-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-6-iodanyl-2-[(2E)-2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-3-[(2-methylphenyl)amino]-1H-quinazolin-4-one
MOLECULAR FORMULA: C24H20IN3O3
MOLECULAR WEIGHT: 525.33837
SMILES: CC1=CC=CC=C1NN2/C(=C/C=C/3\C=CC(=O)C(=C3)OC)/NC4=C(C2=O)C=C(C=C4)I
Structure:
CAS RN: 78922-73-3
CAS Name: (2E)-2-[(2Z)-2-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-3-(5-nitro-2-pyridinyl)-1H-quinazolin-4-one
OPENEYE Name: (2E)-2-[(2Z)-2-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylidene]-3-(5-nitro-2-pyridyl)-1H-quinazolin-4-one
IUPAC Name: (2E)-2-[(2Z)-2-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-3-(5-nitropyridin-2-yl)-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-3-(5-nitropyridin-2-yl)-2-[(2Z)-2-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one
MOLECULAR FORMULA: C21H14N4O5
MOLECULAR WEIGHT: 402.35966
SMILES: C1=CC=C2C(=C1)C(=O)N(/C(=C/C=C\3/C=CC(=O)C=C3O)/N2)C4=NC=C(C=C4)[N+](=O)[O-]
Structure:
CAS RN: 78899-02-2
CAS Name: (2E)-3-(5-nitro-2-pyridinyl)-2-[(2E)-2-(6-oxo-1-cyclohexa-2,4-dienylidene)ethylidene]-1H-quinazolin-4-one
OPENEYE Name: (2E)-3-(5-nitro-2-pyridyl)-2-[(2E)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one
IUPAC Name: (2E)-3-(5-nitropyridin-2-yl)-2-[(2E)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-3-(5-nitropyridin-2-yl)-2-[(2E)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one
MOLECULAR FORMULA: C21H14N4O4
MOLECULAR WEIGHT: 386.36026
SMILES: C1=CC=C2C(=C1)C(=O)N(/C(=C/C=C/3\C=CC=CC3=O)/N2)C4=NC=C(C=C4)[N+](=O)[O-]
Structure:
CAS RN: 36934-39-1
CAS Name: 3-[4-[[(E)-(3,5-dichloro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-2-methyl-4-quinazolinone
OPENEYE Name: 3-[4-[[(E)-(3,5-dichloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-2-methyl-quinazolin-4-one
IUPAC Name: 3-[4-[[(E)-(3,5-dichloro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-2-methylquinazolin-4-one
SYSTEMATIC NAME: 3-[4-[[(E)-[3,5-bis(chloranyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methyl]amino]phenyl]-2-methyl-quinazolin-4-one
MOLECULAR FORMULA: C22H15Cl2N3O2
MOLECULAR WEIGHT: 424.2794
SMILES: CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)N/C=C/4\C=C(C=C(C4=O)Cl)Cl
Structure:
CAS RN: 36934-38-0
CAS Name: 2-methyl-3-[4-[[(E)-(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-4-quinazolinone
OPENEYE Name: 2-methyl-3-[4-[[(E)-(5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
IUPAC Name: 2-methyl-3-[4-[[(E)-(5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
SYSTEMATIC NAME: 2-methyl-3-[4-[[(E)-(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
MOLECULAR FORMULA: C22H16N4O4
MOLECULAR WEIGHT: 400.38684
SMILES: CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)N/C=C/4\C=CC=C(C4=O)[N+](=O)[O-]
Structure:
CAS RN: 36934-37-9
CAS Name: 2-methyl-3-[4-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-4-quinazolinone
OPENEYE Name: 2-methyl-3-[4-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
IUPAC Name: 2-methyl-3-[4-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
SYSTEMATIC NAME: 2-methyl-3-[4-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
MOLECULAR FORMULA: C22H17N3O2
MOLECULAR WEIGHT: 355.38928
SMILES: CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)N/C=C/4\C=CC=CC4=O
Structure:
CAS RN: 36933-80-9
CAS Name: 3-[4-[[(E)-(3,5-dichloro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-6-iodo-2-methyl-4-quinazolinone
OPENEYE Name: 3-[4-[[(E)-(3,5-dichloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-6-iodo-2-methyl-quinazolin-4-one
IUPAC Name: 3-[4-[[(E)-(3,5-dichloro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-6-iodo-2-methylquinazolin-4-one
SYSTEMATIC NAME: 3-[4-[[(E)-[3,5-bis(chloranyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methyl]amino]phenyl]-6-iodanyl-2-methyl-quinazolin-4-one
MOLECULAR FORMULA: C22H14Cl2IN3O2
MOLECULAR WEIGHT: 550.17593
SMILES: CC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=C(C=C3)N/C=C/4\C=C(C=C(C4=O)Cl)Cl
Structure:
CAS RN: 36933-77-4
CAS Name: 6-bromo-3-[4-[[(E)-(3,5-dichloro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-2-methyl-4-quinazolinone
OPENEYE Name: 6-bromo-3-[4-[[(E)-(3,5-dichloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-2-methyl-quinazolin-4-one
IUPAC Name: 6-bromo-3-[4-[[(E)-(3,5-dichloro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-2-methylquinazolin-4-one
SYSTEMATIC NAME: 3-[4-[[(E)-[3,5-bis(chloranyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methyl]amino]phenyl]-6-bromanyl-2-methyl-quinazolin-4-one
MOLECULAR FORMULA: C22H14BrCl2N3O2
MOLECULAR WEIGHT: 503.17546
SMILES: CC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=CC=C(C=C3)N/C=C/4\C=C(C=C(C4=O)Cl)Cl
Structure:
CAS RN: 36933-76-3
CAS Name: 6-bromo-2-methyl-3-[4-[[(E)-(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-4-quinazolinone
OPENEYE Name: 6-bromo-2-methyl-3-[4-[[(E)-(5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
IUPAC Name: 6-bromo-2-methyl-3-[4-[[(E)-(5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
SYSTEMATIC NAME: 6-bromanyl-2-methyl-3-[4-[[(E)-(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
MOLECULAR FORMULA: C22H15BrN4O4
MOLECULAR WEIGHT: 479.2829
SMILES: CC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=CC=C(C=C3)N/C=C/4\C=CC=C(C4=O)[N+](=O)[O-]
Structure:
CAS RN: 36933-75-2
CAS Name: 6-bromo-2-methyl-3-[4-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-4-quinazolinone
OPENEYE Name: 6-bromo-2-methyl-3-[4-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
IUPAC Name: 6-bromo-2-methyl-3-[4-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
SYSTEMATIC NAME: 6-bromanyl-2-methyl-3-[4-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
MOLECULAR FORMULA: C22H16BrN3O2
MOLECULAR WEIGHT: 434.28534
SMILES: CC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=CC=C(C=C3)N/C=C/4\C=CC=CC4=O
Structure:
CAS RN: 28712-44-9
CAS Name: (2Z)-6-chloro-2-(3,5-dichloro-6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-one
OPENEYE Name: (2Z)-6-chloro-2-(3,5-dichloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
IUPAC Name: (2Z)-6-chloro-2-(3,5-dichloro-6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
SYSTEMATIC NAME: (2Z)-2-[3,5-bis(chloranyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-6-chloranyl-1H-quinazolin-4-one
MOLECULAR FORMULA: C14H7Cl3N2O2
MOLECULAR WEIGHT: 341.57658
SMILES: C1=CC2=C(C=C1Cl)C(=O)N/C(=C\3/C=C(C=C(C3=O)Cl)Cl)/N2
Structure:
CAS RN: 114824-90-7
CAS Name: (2E)-2-(3-oxo-2-pyridinylidene)-1H-quinazolin-4-one
OPENEYE Name: (2E)-2-(3-oxo-2-pyridylidene)-1H-quinazolin-4-one
IUPAC Name: (2E)-2-(3-oxopyridin-2-ylidene)-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-2-(3-oxidanylidenepyridin-2-ylidene)-1H-quinazolin-4-one
MOLECULAR FORMULA: C13H9N3O2
MOLECULAR WEIGHT: 239.22946
SMILES: C1=CC=C2C(=C1)C(=O)N/C(=C/3\C(=O)C=CC=N3)/N2
Structure:
CAS RN: 28683-81-0
CAS Name: (2Z)-6-chloro-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-one
OPENEYE Name: (2Z)-6-chloro-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
IUPAC Name: (2Z)-6-chloro-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
SYSTEMATIC NAME: (2Z)-6-chloranyl-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
MOLECULAR FORMULA: C14H9ClN2O2
MOLECULAR WEIGHT: 272.68646
SMILES: C1=C/C(=C/2\NC3=C(C=C(C=C3)Cl)C(=O)N2)/C(=O)C=C1
Structure:
CAS RN: 36933-78-5
CAS Name: 6-iodo-2-methyl-3-[4-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-4-quinazolinone
OPENEYE Name: 6-iodo-2-methyl-3-[4-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
IUPAC Name: 6-iodo-2-methyl-3-[4-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
SYSTEMATIC NAME: 6-iodanyl-2-methyl-3-[4-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]quinazolin-4-one
MOLECULAR FORMULA: C22H16IN3O2
MOLECULAR WEIGHT: 481.28581
SMILES: CC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=C(C=C3)N/C=C/4\C=CC=CC4=O
Structure:
CAS RN: 28683-91-2
CAS Name: (2E)-2-(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)-6-nitro-1H-quinazolin-4-one
OPENEYE Name: (2E)-2-(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-6-nitro-1H-quinazolin-4-one
IUPAC Name: (2E)-2-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-6-nitro-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-2-(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-6-nitro-1H-quinazolin-4-one
MOLECULAR FORMULA: C14H8ClN3O4
MOLECULAR WEIGHT: 317.68402
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N/C(=C/3\C=C(C=CC3=O)Cl)/N2
Structure:
CAS RN: 1033-16-5
CAS Name: (2E)-2-(3,5-dichloro-6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-one
OPENEYE Name: (2E)-2-(3,5-dichloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
IUPAC Name: (2E)-2-(3,5-dichloro-6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-one
SYSTEMATIC NAME: (2E)-2-[3,5-bis(chloranyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-1H-quinazolin-4-one
MOLECULAR FORMULA: C14H8Cl2N2O2
MOLECULAR WEIGHT: 307.13152
SMILES: C1=CC=C2C(=C1)C(=O)N/C(=C/3\C=C(C=C(C3=O)Cl)Cl)/N2
Structure:
CAS RN: 86541-78-8
CAS Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenylbutanoic acid
OPENEYE Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenyl-butanoic acid
IUPAC Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenylbutanoic acid
SYSTEMATIC NAME: (2S)-2-[[(3S)-1-(2-hydroxy-2-oxoethyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenyl-butanoic acid
MOLECULAR FORMULA: C22H24N2O5
MOLECULAR WEIGHT: 396.43636
SMILES: C1CC2=CC=CC=C2N(C(=O)[C@H]1N[C@@H](CCC3=CC=CC=C3)C(=O)O)CC(=O)O
Structure:
CAS RN: 89747-91-1
CAS Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenylbutanoic acid
OPENEYE Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenyl-butanoic acid
IUPAC Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenylbutanoic acid
SYSTEMATIC NAME: (2S)-2-[[(3S)-1-(2-hydroxy-2-oxoethyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenyl-butanoic acid
MOLECULAR FORMULA: C22H24N2O5
MOLECULAR WEIGHT: 396.43636
SMILES: C1CC2=CC=CC=C2N(C(=O)[C@H]1N[C@@H](CCC3=CC=CC=C3)C(=O)O)CC(=O)O
Structure:
CAS RN: 107397-09-1
CAS Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenylbutanoic acid
OPENEYE Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenyl-butanoic acid
IUPAC Name: (2S)-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenylbutanoic acid
SYSTEMATIC NAME: (2S)-2-[[(3S)-1-(2-hydroxy-2-oxoethyl)-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]amino]-4-phenyl-butanoic acid
MOLECULAR FORMULA: C22H24N2O5
MOLECULAR WEIGHT: 396.43636
SMILES: C1CC2=CC=CC=C2N(C(=O)[C@H]1N[C@@H](CCC3=CC=CC=C3)C(=O)O)CC(=O)O
Structure:
CAS RN: 8017-14-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H29NO10
MOLECULAR WEIGHT: 467.46636
SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3C(=O)CC4.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.O
Structure:
CAS RN: 143-71-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H27NO9
MOLECULAR WEIGHT: 449.45108
SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3C(=O)CC4.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 163663-19-2
CAS Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-2-indenyl)-8-quinolinyl]isoindole-1,3-dione
OPENEYE Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-indan-2-yl)-8-quinolyl]isoindoline-1,3-dione
IUPAC Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxoinden-2-yl)quinolin-8-yl]isoindole-1,3-dione
SYSTEMATIC NAME: 4,5,6,7-tetrakis(chloranyl)-2-[2-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)inden-2-yl]quinolin-8-yl]isoindole-1,3-dione
MOLECULAR FORMULA: C26H6Cl8N2O4
MOLECULAR WEIGHT: 693.96084
SMILES: C1=CC2=C(C(=C1)N3C(=O)C4=C(C3=O)C(=C(C(=C4Cl)Cl)Cl)Cl)N=C(C=C2)C5C(=O)C6=C(C5=O)C(=C(C(=C6Cl)Cl)Cl)Cl
Structure:
CAS RN: 30125-47-4
CAS Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-2-indenyl)-8-quinolinyl]isoindole-1,3-dione
OPENEYE Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-indan-2-yl)-8-quinolyl]isoindoline-1,3-dione
IUPAC Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxoinden-2-yl)quinolin-8-yl]isoindole-1,3-dione
SYSTEMATIC NAME: 4,5,6,7-tetrakis(chloranyl)-2-[2-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)inden-2-yl]quinolin-8-yl]isoindole-1,3-dione
MOLECULAR FORMULA: C26H6Cl8N2O4
MOLECULAR WEIGHT: 693.96084
SMILES: C1=CC2=C(C(=C1)N3C(=O)C4=C(C3=O)C(=C(C(=C4Cl)Cl)Cl)Cl)N=C(C=C2)C5C(=O)C6=C(C5=O)C(=C(C(=C6Cl)Cl)Cl)Cl
Structure:
CAS RN: 340700-36-9
CAS Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-2-indenyl)-8-quinolinyl]isoindole-1,3-dione
OPENEYE Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-indan-2-yl)-8-quinolyl]isoindoline-1,3-dione
IUPAC Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxoinden-2-yl)quinolin-8-yl]isoindole-1,3-dione
SYSTEMATIC NAME: 4,5,6,7-tetrakis(chloranyl)-2-[2-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)inden-2-yl]quinolin-8-yl]isoindole-1,3-dione
MOLECULAR FORMULA: C26H6Cl8N2O4
MOLECULAR WEIGHT: 693.96084
SMILES: C1=CC2=C(C(=C1)N3C(=O)C4=C(C3=O)C(=C(C(=C4Cl)Cl)Cl)Cl)N=C(C=C2)C5C(=O)C6=C(C5=O)C(=C(C(=C6Cl)Cl)Cl)Cl
Structure:
CAS RN: 56731-19-2
CAS Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-2-indenyl)-8-quinolinyl]isoindole-1,3-dione
OPENEYE Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-indan-2-yl)-8-quinolyl]isoindoline-1,3-dione
IUPAC Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxoinden-2-yl)quinolin-8-yl]isoindole-1,3-dione
SYSTEMATIC NAME: 4,5,6,7-tetrakis(chloranyl)-2-[2-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)inden-2-yl]quinolin-8-yl]isoindole-1,3-dione
MOLECULAR FORMULA: C26H6Cl8N2O4
MOLECULAR WEIGHT: 693.96084
SMILES: C1=CC2=C(C(=C1)N3C(=O)C4=C(C3=O)C(=C(C(=C4Cl)Cl)Cl)Cl)N=C(C=C2)C5C(=O)C6=C(C5=O)C(=C(C(=C6Cl)Cl)Cl)Cl
Structure:
CAS RN: 72779-84-1
CAS Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-2-indenyl)-8-quinolinyl]isoindole-1,3-dione
OPENEYE Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxo-indan-2-yl)-8-quinolyl]isoindoline-1,3-dione
IUPAC Name: 4,5,6,7-tetrachloro-2-[2-(4,5,6,7-tetrachloro-1,3-dioxoinden-2-yl)quinolin-8-yl]isoindole-1,3-dione
SYSTEMATIC NAME: 4,5,6,7-tetrakis(chloranyl)-2-[2-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)inden-2-yl]quinolin-8-yl]isoindole-1,3-dione
MOLECULAR FORMULA: C26H6Cl8N2O4
MOLECULAR WEIGHT: 693.96084
SMILES: C1=CC2=C(C(=C1)N3C(=O)C4=C(C3=O)C(=C(C(=C4Cl)Cl)Cl)Cl)N=C(C=C2)C5C(=O)C6=C(C5=O)C(=C(C(=C6Cl)Cl)Cl)Cl
Structure:
CAS RN: 26446-61-7
CAS Name: 3-chloroprop-1-en-2-ylbenzene
OPENEYE Name: 1-(chloromethyl)vinylbenzene
IUPAC Name: 3-chloroprop-1-en-2-ylbenzene
SYSTEMATIC NAME: 3-chloranylprop-1-en-2-ylbenzene
MOLECULAR FORMULA: C9H9Cl
MOLECULAR WEIGHT: 152.62076
SMILES: C=C(CCl)C1=CC=CC=C1
Structure:
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