2-azanyl-4-[4-(benzimidazol-1-ylmethyl)thiophen-2-yl]-1-(3-chlorophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-(benzimidazol-1-ylmethyl)thiophen-2-yl]-1-(3-chlorophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-[4-(benzimidazol-1-ylmethyl)-2-thienyl]-1-(3-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-[4-(1-benzimidazolylmethyl)-2-thiophenyl]-1-(3-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-[4-(benzimidazol-1-ylmethyl)thiophen-2-yl]-1-(3-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-[4-(benzimidazol-1-ylmethyl)-2-thienyl]-1-(3-chlorophenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C30H26ClN5OS MolecularWeight: 540.07834

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)Cl)N)C#N)C4=CC(=CS4)CN5C=NC6=CC=CC=C65)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)Cl)N)C#N)C4=CC(=CS4)CN5C=NC6=CC=CC=C65)C(=O)C1)C

InChI

InChI=1S/C30H26ClN5OS/c1-30(2)12-24-28(25(37)13-30)27(21(14-32)29(33)36(24)20-7-5-6-19(31)11-20)26-10-18(16-38-26)15-35-17-34-22-8-3-4-9-23(22)35/h3-11,16-17,27H,12-13,15,33H2,1-2H3