2-azanyl-5-oxidanylidene-4-(3-phenoxyphenyl)-7-phenyl-1-(1H-1,2,4-triazol-5-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-5-oxidanylidene-4-(3-phenoxyphenyl)-7-phenyl-1-(1H-1,2,4-triazol-5-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-5-oxo-4-(3-phenoxyphenyl)-7-phenyl-1-(1H-1,2,4-triazol-5-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-5-oxo-4-(3-phenoxyphenyl)-7-phenyl-1-(1H-1,2,4-triazol-5-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-5-oxo-4-(3-phenoxyphenyl)-7-phenyl-1-(1H-1,2,4-triazol-5-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-5-keto-4-(3-phenoxyphenyl)-7-phenyl-1-(1H-1,2,4-triazol-5-yl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C30H24N6O2 MolecularWeight: 500.55056

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=C1N(C(=C(C2C3=CC(=CC=C3)OC4=CC=CC=C4)C#N)N)C5=NC=NN5)C6=CC=CC=C6

Isomeric SMILES

C1C(CC(=O)C2=C1N(C(=C(C2C3=CC(=CC=C3)OC4=CC=CC=C4)C#N)N)C5=NC=NN5)C6=CC=CC=C6

InChI

InChI=1S/C30H24N6O2/c31-17-24-27(20-10-7-13-23(14-20)38-22-11-5-2-6-12-22)28-25(36(29(24)32)30-33-18-34-35-30)15-21(16-26(28)37)19-8-3-1-4-9-19/h1-14,18,21,27H,15-16,32H2,(H,33,34,35)