4-(3,4-dimethoxyphenyl)-2-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione

Systemtic Name: 4-(3,4-dimethoxyphenyl)-2-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione Openeye Name: 4-(3,4-dimethoxyphenyl)-2-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione CAS Name: 4-(3,4-dimethoxyphenyl)-2-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione IUPAC Name: 4-(3,4-dimethoxyphenyl)-2-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione Traditional Name: 4-(3,4-dimethoxyphenyl)-2-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione Formula: C27H22N2O2S MolecularWeight: 438.54078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NC3=C2CC(=S)NC4=CC=CC=C43)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NC3=C2CC(=S)NC4=CC=CC=C43)C5=CC=CC=C5)OC

InChI

InChI=1S/C27H22N2O2S/c1-30-24-13-12-18(14-25(24)31-2)20-15-23(17-8-4-3-5-9-17)29-27-19-10-6-7-11-22(19)28-26(32)16-21(20)27/h3-15H,16H2,1-2H3,(H,28,32)