CAS RN: 60311-21-9
CAS Name: N-[2-[2-(2-quinoxalinylamino)ethyldisulfanyl]ethyl]-2-quinoxalinamine
OPENEYE Name: N-[2-[2-(quinoxalin-2-ylamino)ethyldisulfanyl]ethyl]quinoxalin-2-amine
IUPAC Name: N-[2-[2-(quinoxalin-2-ylamino)ethyldisulfanyl]ethyl]quinoxalin-2-amine
SYSTEMATIC NAME: N-[2-[2-(quinoxalin-2-ylamino)ethyldisulfanyl]ethyl]quinoxalin-2-amine
MOLECULAR FORMULA: C20H20N6S2
MOLECULAR WEIGHT: 408.543
SMILES: C1=CC=C2C(=C1)N=CC(=N2)NCCSSCCNC3=NC4=CC=CC=C4N=C3
Structure:
CAS RN: 38478-71-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H10N2O
MOLECULAR WEIGHT: 270.2848
SMILES: C1=CC=C2C(=C1)C3=NC=CC4=C3N(C2=O)C5=CC=CC=C45
Structure:
CAS RN: 328265-52-7
CAS Name: 2-(3-oxo-2,4-dihydro-1H-cyclopenta[b]indol-2-yl)isoindole-1,3-dione
OPENEYE Name: 2-(3-oxo-2,4-dihydro-1H-cyclopenta[b]indol-2-yl)isoindoline-1,3-dione
IUPAC Name: 2-(3-oxo-2,4-dihydro-1H-cyclopenta[b]indol-2-yl)isoindole-1,3-dione
SYSTEMATIC NAME: 2-(3-oxidanylidene-2,4-dihydro-1H-cyclopenta[b]indol-2-yl)isoindole-1,3-dione
MOLECULAR FORMULA: C19H12N2O3
MOLECULAR WEIGHT: 316.31018
SMILES: C1C(C(=O)C2=C1C3=CC=CC=C3N2)N4C(=O)C5=CC=CC=C5C4=O
Structure:
CAS RN: 6428-76-8
CAS Name: 2,3,5-trihydroxy-7-oxabicyclo[3.2.1]octan-6-one
OPENEYE Name: 2,3,5-trihydroxy-7-oxabicyclo[3.2.1]octan-6-one
IUPAC Name: 2,3,5-trihydroxy-7-oxabicyclo[3.2.1]octan-6-one
SYSTEMATIC NAME: 2,3,5-tris(oxidanyl)-7-oxabicyclo[3.2.1]octan-6-one
MOLECULAR FORMULA: C7H10O5
MOLECULAR WEIGHT: 174.1513
SMILES: C1C(C(C2CC1(C(=O)O2)O)O)O
Structure:
CAS RN: 22065-99-2
CAS Name: 6-methoxy-N4,N4-dimethylquinoline-4,8-diamine
OPENEYE Name: 6-methoxy-N4,N4-dimethyl-quinoline-4,8-diamine
IUPAC Name: 6-methoxy-4-N,4-N-dimethylquinoline-4,8-diamine
SYSTEMATIC NAME: 6-methoxy-N4,N4-dimethyl-quinoline-4,8-diamine
MOLECULAR FORMULA: C12H15N3O
MOLECULAR WEIGHT: 217.267
SMILES: CN(C)C1=C2C=C(C=C(C2=NC=C1)N)OC
Structure:
CAS RN: 21430-85-3
CAS Name: 5-(2-phenylethyl)-1H-pyrimidine-2,4-dione
OPENEYE Name: 5-(2-phenylethyl)-1H-pyrimidine-2,4-dione
IUPAC Name: 5-(2-phenylethyl)-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 5-(2-phenylethyl)-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C12H12N2O2
MOLECULAR WEIGHT: 216.23588
SMILES: C1=CC=C(C=C1)CCC2=CNC(=O)NC2=O
Structure:
CAS RN: 4692-98-2
CAS Name: 6-bromo-1H-3,1-benzoxazine-2,4-dione
OPENEYE Name: 6-bromo-1H-3,1-benzoxazine-2,4-dione
IUPAC Name: 6-bromo-1H-3,1-benzoxazine-2,4-dione
SYSTEMATIC NAME: 6-bromanyl-1H-3,1-benzoxazine-2,4-dione
MOLECULAR FORMULA: C8H4BrNO3
MOLECULAR WEIGHT: 242.02626
SMILES: C1=CC2=C(C=C1Br)C(=O)OC(=O)N2
Structure:
CAS RN: 321-69-7
CAS Name: 6-fluoro-1H-3,1-benzoxazine-2,4-dione
OPENEYE Name: 6-fluoro-1H-3,1-benzoxazine-2,4-dione
IUPAC Name: 6-fluoro-1H-3,1-benzoxazine-2,4-dione
SYSTEMATIC NAME: 6-fluoranyl-1H-3,1-benzoxazine-2,4-dione
MOLECULAR FORMULA: C8H4FNO3
MOLECULAR WEIGHT: 181.120663
SMILES: C1=CC2=C(C=C1F)C(=O)OC(=O)N2
Structure:
CAS RN: 2511-91-3
CAS Name: 3-(3-chloroanilino)-1-(3-chlorophenyl)pyrrole-2,5-dione
OPENEYE Name: 3-(3-chloroanilino)-1-(3-chlorophenyl)pyrrole-2,5-dione
IUPAC Name: 3-(3-chloroanilino)-1-(3-chlorophenyl)pyrrole-2,5-dione
SYSTEMATIC NAME: 1-(3-chlorophenyl)-3-[(3-chlorophenyl)amino]pyrrole-2,5-dione
MOLECULAR FORMULA: C16H10Cl2N2O2
MOLECULAR WEIGHT: 333.1688
SMILES: C1=CC(=CC(=C1)Cl)NC2=CC(=O)N(C2=O)C3=CC(=CC=C3)Cl
Structure:
CAS RN: 18164-50-6
CAS Name: 2-(4-methoxy-6-oxo-2-pyranyl)acetic acid
OPENEYE Name: 2-(4-methoxy-6-oxo-pyran-2-yl)acetic acid
IUPAC Name: 2-(4-methoxy-6-oxopyran-2-yl)acetic acid
SYSTEMATIC NAME: 2-(4-methoxy-6-oxidanylidene-pyran-2-yl)ethanoic acid
MOLECULAR FORMULA: C8H8O5
MOLECULAR WEIGHT: 184.14612
SMILES: COC1=CC(=O)OC(=C1)CC(=O)O
Structure:
CAS RN: 27685-92-3
CAS Name: 5H-thieno[3,2-c]pyridin-4-one
OPENEYE Name: 5H-thieno[3,2-c]pyridin-4-one
IUPAC Name: 5H-thieno[3,2-c]pyridin-4-one
SYSTEMATIC NAME: 5H-thieno[3,2-c]pyridin-4-one
MOLECULAR FORMULA: C7H5NOS
MOLECULAR WEIGHT: 151.1857
SMILES: C1=CNC(=O)C2=C1SC=C2
Structure:
CAS RN: 1605-08-9
CAS Name: 2-phenyl-3-(phenylmethyl)aziridine
OPENEYE Name: 2-benzyl-3-phenyl-aziridine
IUPAC Name: 2-benzyl-3-phenylaziridine
SYSTEMATIC NAME: 2-phenyl-3-(phenylmethyl)aziridine
MOLECULAR FORMULA: C15H15N
MOLECULAR WEIGHT: 209.2863
SMILES: C1=CC=C(C=C1)CC2C(N2)C3=CC=CC=C3
Structure:
CAS RN: 50645-66-4
CAS Name: (2-tert-butyl-3-phenyl-1,2,4-oxadiazinan-4-yl)-(4-nitrophenyl)methanone
OPENEYE Name: (2-tert-butyl-3-phenyl-1,2,4-oxadiazinan-4-yl)-(4-nitrophenyl)methanone
IUPAC Name: (2-tert-butyl-3-phenyl-1,2,4-oxadiazinan-4-yl)-(4-nitrophenyl)methanone
SYSTEMATIC NAME: (2-tert-butyl-3-phenyl-1,2,4-oxadiazinan-4-yl)-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C20H23N3O4
MOLECULAR WEIGHT: 369.41432
SMILES: CC(C)(C)N1C(N(CCO1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3
Structure:
CAS RN: 5064-55-1
CAS Name: [2-(4-methylphenyl)-3-phenyl-1,2,4-oxadiazinan-4-yl]-(4-nitrophenyl)methanone
OPENEYE Name: (4-nitrophenyl)-[3-phenyl-2-(p-tolyl)-1,2,4-oxadiazinan-4-yl]methanone
IUPAC Name: [2-(4-methylphenyl)-3-phenyl-1,2,4-oxadiazinan-4-yl]-(4-nitrophenyl)methanone
SYSTEMATIC NAME: [2-(4-methylphenyl)-3-phenyl-1,2,4-oxadiazinan-4-yl]-(4-nitrophenyl)methanone
MOLECULAR FORMULA: C23H21N3O4
MOLECULAR WEIGHT: 403.43054
SMILES: CC1=CC=C(C=C1)N2C(N(CCO2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4
Structure:
CAS RN: 50905-12-9
CAS Name: (3,5-dinitrophenyl)-[2-(4-methylphenyl)-3-phenyl-1,2,4-oxadiazinan-4-yl]methanone
OPENEYE Name: (3,5-dinitrophenyl)-[3-phenyl-2-(p-tolyl)-1,2,4-oxadiazinan-4-yl]methanone
IUPAC Name: (3,5-dinitrophenyl)-[2-(4-methylphenyl)-3-phenyl-1,2,4-oxadiazinan-4-yl]methanone
SYSTEMATIC NAME: (3,5-dinitrophenyl)-[2-(4-methylphenyl)-3-phenyl-1,2,4-oxadiazinan-4-yl]methanone
MOLECULAR FORMULA: C23H20N4O6
MOLECULAR WEIGHT: 448.4281
SMILES: CC1=CC=C(C=C1)N2C(N(CCO2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4
Structure:
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