2-[3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]sulfanyl-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]sulfanyl-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridine-3-carbonitrile Openeye Name: 4-(2,3-dimethoxyphenyl)-2-(3-indolin-1-yl-3-oxo-propyl)sulfanyl-6-phenyl-pyridine-3-carbonitrile CAS Name: 2-[[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]thio]-4-(2,3-dimethoxyphenyl)-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]sulfanyl-4-(2,3-dimethoxyphenyl)-6-phenylpyridine-3-carbonitrile Traditional Name: 4-(2,3-dimethoxyphenyl)-2-[(3-indolin-1-yl-3-keto-propyl)thio]-6-phenyl-nicotinonitrile Formula: C31H27N3O3S MolecularWeight: 521.62938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=CC(=NC(=C2C#N)SCCC(=O)N3CCC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=CC(=NC(=C2C#N)SCCC(=O)N3CCC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C31H27N3O3S/c1-36-28-14-8-12-23(30(28)37-2)24-19-26(21-9-4-3-5-10-21)33-31(25(24)20-32)38-18-16-29(35)34-17-15-22-11-6-7-13-27(22)34/h3-14,19H,15-18H2,1-2H3