(4S,7R)-2-azanyl-1-(2-chlorophenyl)-5-oxidanylidene-7-phenyl-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (4S,7R)-2-azanyl-1-(2-chlorophenyl)-5-oxidanylidene-7-phenyl-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (4S,7R)-2-amino-1-(2-chlorophenyl)-5-oxo-7-phenyl-4-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: (4S,7R)-2-amino-1-(2-chlorophenyl)-5-oxo-7-phenyl-4-(3-pyridinyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (4S,7R)-2-amino-1-(2-chlorophenyl)-5-oxo-7-phenyl-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (4S,7R)-2-amino-1-(2-chlorophenyl)-5-keto-7-phenyl-4-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C27H21ClN4O MolecularWeight: 452.93484

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=C1N(C(=C(C2C3=CN=CC=C3)C#N)N)C4=CC=CC=C4Cl)C5=CC=CC=C5

Isomeric SMILES

C1[C@H](CC(=O)C2=C1N(C(=C([C@@H]2C3=CN=CC=C3)C#N)N)C4=CC=CC=C4Cl)C5=CC=CC=C5

InChI

InChI=1S/C27H21ClN4O/c28-21-10-4-5-11-22(21)32-23-13-19(17-7-2-1-3-8-17)14-24(33)26(23)25(20(15-29)27(32)30)18-9-6-12-31-16-18/h1-12,16,19,25H,13-14,30H2/t19-,25+/m1/s1