CAS RN: 6035-04-7
CAS Name: (2-methoxyphenyl)-(3-methyl-2-propyl-4-imidazolyl)methanol
OPENEYE Name: (2-methoxyphenyl)-(3-methyl-2-propyl-imidazol-4-yl)methanol
IUPAC Name: (2-methoxyphenyl)-(3-methyl-2-propylimidazol-4-yl)methanol
SYSTEMATIC NAME: (2-methoxyphenyl)-(3-methyl-2-propyl-imidazol-4-yl)methanol
MOLECULAR FORMULA: C15H20N2O2
MOLECULAR WEIGHT: 260.3315
SMILES: CCCC1=NC=C(N1C)C(C2=CC=CC=C2OC)O
Structure:
CAS RN: 6034-62-4
CAS Name: 3-acetyl-2-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-hydroxy-2H-pyrrol-5-one
OPENEYE Name: 3-acetyl-2-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-hydroxy-2H-pyrrol-5-one
IUPAC Name: 3-acetyl-2-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-hydroxy-2H-pyrrol-5-one
SYSTEMATIC NAME: 2-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-ethanoyl-4-oxidanyl-2H-pyrrol-5-one
MOLECULAR FORMULA: C18H24N2O5
MOLECULAR WEIGHT: 348.39356
SMILES: CC(=O)C1=C(C(=O)N(C1C2=CC(=C(C=C2)OC)OC)CCN(C)C)O
Structure:
CAS RN: 6034-10-2
CAS Name: 2-(2,4-dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-thiazolidinone
OPENEYE Name: 2-(2,4-dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiazolidin-4-one
IUPAC Name: 2-(2,4-dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 2-(2,4-dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C21H25NO5S
MOLECULAR WEIGHT: 403.4919
SMILES: COC1=CC(=C(C=C1)C2N(C(=O)CS2)CCC3=CC(=C(C=C3)OC)OC)OC
Structure:
CAS RN: 6033-83-6
CAS Name: 6-amino-3-phenyl-4-(1-phenylethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
OPENEYE Name: 6-amino-3-phenyl-4-(1-phenylethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC Name: 6-amino-3-phenyl-4-(1-phenylethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: 6-azanyl-3-phenyl-4-(1-phenylethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C21H18N4O
MOLECULAR WEIGHT: 342.39382
SMILES: CC(C1C(=C(OC2=NNC(=C12)C3=CC=CC=C3)N)C#N)C4=CC=CC=C4
Structure:
CAS RN: 6033-79-0
CAS Name: 4-hydroxy-4-methyl-2-(4-methylphenyl)-6-oxocyclohexane-1,3-dicarboxylic acid dipropan-2-yl ester
OPENEYE Name: diisopropyl 4-hydroxy-4-methyl-6-oxo-2-(p-tolyl)cyclohexane-1,3-dicarboxylate
IUPAC Name: dipropan-2-yl 4-hydroxy-4-methyl-2-(4-methylphenyl)-6-oxocyclohexane-1,3-dicarboxylate
SYSTEMATIC NAME: dipropan-2-yl 4-methyl-2-(4-methylphenyl)-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate
MOLECULAR FORMULA: C22H30O6
MOLECULAR WEIGHT: 390.47
SMILES: CC1=CC=C(C=C1)C2C(C(=O)CC(C2C(=O)OC(C)C)(C)O)C(=O)OC(C)C
Structure:
CAS RN: 6033-69-8
CAS Name: 6-amino-4-pentan-3-yl-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
OPENEYE Name: 6-amino-4-(1-ethylpropyl)-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
IUPAC Name: 6-amino-4-pentan-3-yl-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SYSTEMATIC NAME: 6-azanyl-4-pentan-3-yl-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
MOLECULAR FORMULA: C18H20N4O
MOLECULAR WEIGHT: 308.3776
SMILES: CCC(CC)C1C(=C(OC2=NNC(=C12)C3=CC=CC=C3)N)C#N
Structure:
CAS RN: 6033-62-1
CAS Name: (3-methoxyphenyl)-(1-propyl-2-benzimidazolyl)methanol
OPENEYE Name: (3-methoxyphenyl)-(1-propylbenzimidazol-2-yl)methanol
IUPAC Name: (3-methoxyphenyl)-(1-propylbenzimidazol-2-yl)methanol
SYSTEMATIC NAME: (3-methoxyphenyl)-(1-propylbenzimidazol-2-yl)methanol
MOLECULAR FORMULA: C18H20N2O2
MOLECULAR WEIGHT: 296.3636
SMILES: CCCN1C2=CC=CC=C2N=C1C(C3=CC(=CC=C3)OC)O
Structure:
CAS RN: 6033-45-0
CAS Name: [4-fluoro-2-nitro-5-(1-piperidinyl)phenyl]-(1-piperidinyl)methanone
OPENEYE Name: [4-fluoro-2-nitro-5-(1-piperidyl)phenyl]-(1-piperidyl)methanone
IUPAC Name: (4-fluoro-2-nitro-5-piperidin-1-ylphenyl)-piperidin-1-ylmethanone
SYSTEMATIC NAME: (4-fluoranyl-2-nitro-5-piperidin-1-yl-phenyl)-piperidin-1-yl-methanone
MOLECULAR FORMULA: C17H22FN3O3
MOLECULAR WEIGHT: 335.373283
SMILES: C1CCN(CC1)C2=C(C=C(C(=C2)C(=O)N3CCCCC3)[N+](=O)[O-])F
Structure:
CAS RN: 6033-18-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H16ClNO4
MOLECULAR WEIGHT: 429.85184
SMILES: C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)C6=CC(=C(C=C6)C(=O)O)Cl
Structure:
CAS RN: 6033-09-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H18N2O2
MOLECULAR WEIGHT: 366.41192
SMILES: CC1=C(N=CC=C1)N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
Structure:
CAS RN: 6032-75-3
CAS Name: 5-[(4-ethoxyphenyl)methyl]-6-hydroxy-1-phenyl-2-sulfanylidene-4-pyrimidinone
OPENEYE Name: 5-[(4-ethoxyphenyl)methyl]-6-hydroxy-1-phenyl-2-thioxo-pyrimidin-4-one
IUPAC Name: 5-[(4-ethoxyphenyl)methyl]-6-hydroxy-1-phenyl-2-sulfanylidenepyrimidin-4-one
SYSTEMATIC NAME: 5-[(4-ethoxyphenyl)methyl]-6-oxidanyl-1-phenyl-2-sulfanylidene-pyrimidin-4-one
MOLECULAR FORMULA: C19H18N2O3S
MOLECULAR WEIGHT: 354.42282
SMILES: CCOC1=CC=C(C=C1)CC2=C(N(C(=S)NC2=O)C3=CC=CC=C3)O
Structure:
CAS RN: 6031-88-5
CAS Name: 2-(4-chloro-3,5-dimethylphenoxy)-N-[2-(3-pyridinyl)-1,3-benzoxazol-5-yl]acetamide
OPENEYE Name: 2-(4-chloro-3,5-dimethyl-phenoxy)-N-[2-(3-pyridyl)-1,3-benzoxazol-5-yl]acetamide
IUPAC Name: 2-(4-chloro-3,5-dimethylphenoxy)-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)acetamide
SYSTEMATIC NAME: 2-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)ethanamide
MOLECULAR FORMULA: C22H18ClN3O3
MOLECULAR WEIGHT: 407.84962
SMILES: CC1=CC(=CC(=C1Cl)C)OCC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CN=CC=C4
Structure:
CAS RN: 6027-84-5
CAS Name: [4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-phenylmethanone
OPENEYE Name: [4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]-phenyl-methanone
IUPAC Name: [4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-phenylmethanone
SYSTEMATIC NAME: [4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]-phenyl-methanone
MOLECULAR FORMULA: C17H16ClN3O3
MOLECULAR WEIGHT: 345.78024
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C3=CC=CC=C3
Structure:
CAS RN: 6026-50-2
CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-(4-methoxyphenyl)butanamide
OPENEYE Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(4-methoxyphenyl)butanamide
IUPAC Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(4-methoxyphenyl)butanamide
SYSTEMATIC NAME: 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-methoxyphenyl)butanamide
MOLECULAR FORMULA: C23H20N2O4
MOLECULAR WEIGHT: 388.4159
SMILES: COC1=CC=C(C=C1)NC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O
Structure:
CAS RN: 6025-49-6
CAS Name: N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-2-(4-methoxyphenoxy)acetamide
OPENEYE Name: N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-2-(4-methoxyphenoxy)acetamide
IUPAC Name: N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-2-(4-methoxyphenoxy)acetamide
SYSTEMATIC NAME: N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-2-(4-methoxyphenoxy)ethanamide
MOLECULAR FORMULA: C22H16Cl2N2O4
MOLECULAR WEIGHT: 443.27944
SMILES: COC1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=C(C=C4)Cl)Cl
Structure:
CAS RN: 6020-64-0
CAS Name: 5-(3-chloro-4-methylphenyl)-N-(2-methyl-4-nitrophenyl)-2-furancarboxamide
OPENEYE Name: 5-(3-chloro-4-methyl-phenyl)-N-(2-methyl-4-nitro-phenyl)furan-2-carboxamide
IUPAC Name: 5-(3-chloro-4-methylphenyl)-N-(2-methyl-4-nitrophenyl)furan-2-carboxamide
SYSTEMATIC NAME: 5-(3-chloranyl-4-methyl-phenyl)-N-(2-methyl-4-nitro-phenyl)furan-2-carboxamide
MOLECULAR FORMULA: C19H15ClN2O4
MOLECULAR WEIGHT: 370.7864
SMILES: CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])C)Cl
Structure:
CAS RN: 6015-86-7
CAS Name: [4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-(5-nitro-2-furanyl)methanone
OPENEYE Name: [4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]-(5-nitro-2-furyl)methanone
IUPAC Name: [4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-(5-nitrofuran-2-yl)methanone
SYSTEMATIC NAME: [4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]-(5-nitrofuran-2-yl)methanone
MOLECULAR FORMULA: C15H13ClN4O6
MOLECULAR WEIGHT: 380.73992
SMILES: C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C3=CC=C(O3)[N+](=O)[O-]
Structure:
CAS RN: 6015-59-4
CAS Name: 1-[2-(4-bromoanilino)-1-cyclohexenyl]-2,2,2-trifluoroethanone
OPENEYE Name: 1-[2-(4-bromoanilino)cyclohexen-1-yl]-2,2,2-trifluoro-ethanone
IUPAC Name: 1-[2-(4-bromoanilino)cyclohexen-1-yl]-2,2,2-trifluoroethanone
SYSTEMATIC NAME: 1-[2-[(4-bromophenyl)amino]cyclohexen-1-yl]-2,2,2-tris(fluoranyl)ethanone
MOLECULAR FORMULA: C14H13BrF3NO
MOLECULAR WEIGHT: 348.15833
SMILES: C1CCC(=C(C1)C(=O)C(F)(F)F)NC2=CC=C(C=C2)Br
Structure:
CAS RN: 6015-45-8
CAS Name: (3-bromo-4-ethoxyphenyl)-[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]methanone
OPENEYE Name: (3-bromo-4-ethoxy-phenyl)-[4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]methanone
IUPAC Name: (3-bromo-4-ethoxyphenyl)-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]methanone
SYSTEMATIC NAME: (3-bromanyl-4-ethoxy-phenyl)-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C19H19BrClN3O4
MOLECULAR WEIGHT: 468.72886
SMILES: CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)Br
Structure:
CAS RN: 6015-33-4
CAS Name: N-(2-methyl-4-nitrophenyl)-2-oxo-8-prop-2-enyl-1-benzopyran-3-carboxamide
OPENEYE Name: 8-allyl-N-(2-methyl-4-nitro-phenyl)-2-oxo-chromene-3-carboxamide
IUPAC Name: N-(2-methyl-4-nitrophenyl)-2-oxo-8-prop-2-enylchromene-3-carboxamide
SYSTEMATIC NAME: N-(2-methyl-4-nitro-phenyl)-2-oxidanylidene-8-prop-2-enyl-chromene-3-carboxamide
MOLECULAR FORMULA: C20H16N2O5
MOLECULAR WEIGHT: 364.35144
SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=CC3=C(C(=CC=C3)CC=C)OC2=O
Structure:
CAS RN: 6014-85-3
CAS Name: 5-[[1-(3,5-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-[[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-[[1-(3,5-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-[[1-(3,5-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C18H18N2OS2
MOLECULAR WEIGHT: 342.47832
SMILES: CC1=CC(=CC(=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=S)S3)C)C
Structure:
CAS RN: 6014-37-5
CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-thiophenecarboxamide
OPENEYE Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]thiophene-2-carboxamide
IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[3-(1,3-benzothiazol-2-yl)phenyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C18H12N2OS2
MOLECULAR WEIGHT: 336.43068
SMILES: C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)C4=CC=CS4
Structure:
CAS RN: 6013-42-9
CAS Name: 2-[4-oxo-4-(1-piperidinyl)butyl]benzo[de]isoquinoline-1,3-dione
OPENEYE Name: 2-[4-oxo-4-(1-piperidyl)butyl]benzo[de]isoquinoline-1,3-dione
IUPAC Name: 2-(4-oxo-4-piperidin-1-ylbutyl)benzo[de]isoquinoline-1,3-dione
SYSTEMATIC NAME: 2-(4-oxidanylidene-4-piperidin-1-yl-butyl)benzo[de]isoquinoline-1,3-dione
MOLECULAR FORMULA: C21H22N2O3
MOLECULAR WEIGHT: 350.41098
SMILES: C1CCN(CC1)C(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O
Structure:
CAS RN: 6012-42-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H17N3O3
MOLECULAR WEIGHT: 371.38868
SMILES: CC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4C3=O)NC5=C2C(=O)NC(=O)N5C
Structure:
CAS RN: 6003-48-1
CAS Name: 3-iodo-N-[2-(4-morpholinyl)ethyl]benzamide
OPENEYE Name: 3-iodo-N-(2-morpholinoethyl)benzamide
IUPAC Name: 3-iodo-N-(2-morpholin-4-ylethyl)benzamide
SYSTEMATIC NAME: 3-iodanyl-N-(2-morpholin-4-ylethyl)benzamide
MOLECULAR FORMULA: C13H17IN2O2
MOLECULAR WEIGHT: 360.19075
SMILES: C1COCCN1CCNC(=O)C2=CC(=CC=C2)I
Structure:
CAS RN: 6002-58-0
CAS Name: 2-tert-butyl-5-hydroxy-2-methyl-5-(1,1,2,2-tetrafluoroethyl)-3-oxolanone
OPENEYE Name: 2-tert-butyl-5-hydroxy-2-methyl-5-(1,1,2,2-tetrafluoroethyl)tetrahydrofuran-3-one
IUPAC Name: 2-tert-butyl-5-hydroxy-2-methyl-5-(1,1,2,2-tetrafluoroethyl)oxolan-3-one
SYSTEMATIC NAME: 2-tert-butyl-2-methyl-5-oxidanyl-5-[1,1,2,2-tetrakis(fluoranyl)ethyl]oxolan-3-one
MOLECULAR FORMULA: C11H16F4O3
MOLECULAR WEIGHT: 272.236553
SMILES: CC1(C(=O)CC(O1)(C(C(F)F)(F)F)O)C(C)(C)C
Structure:
CAS RN: 120354-25-8
CAS Name: 3-amino-6-methyl-2-(phenylmethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
OPENEYE Name: 3-amino-2-benzyl-6-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one
IUPAC Name: 3-amino-2-benzyl-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
SYSTEMATIC NAME: 3-azanyl-6-methyl-2-(phenylmethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
MOLECULAR FORMULA: C18H19N3OS
MOLECULAR WEIGHT: 325.42796
SMILES: CC1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)N)CC4=CC=CC=C4
Structure:
CAS RN: 6000-33-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H24N4OS2
MOLECULAR WEIGHT: 424.58216
SMILES: CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C4=NNC(=S)N34)CC5=CC=CC=C5
Structure:
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