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

Systemtic Name: 2-[3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]sulfanyl-4-(4-methoxyphenyl)-6-phenyl-pyridine-3-carbonitrile Openeye Name: 2-(3-indolin-1-yl-3-oxo-propyl)sulfanyl-4-(4-methoxyphenyl)-6-phenyl-pyridine-3-carbonitrile CAS Name: 2-[[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]thio]-4-(4-methoxyphenyl)-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]sulfanyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile Traditional Name: 2-[(3-indolin-1-yl-3-keto-propyl)thio]-4-(4-methoxyphenyl)-6-phenyl-nicotinonitrile Formula: C30H25N3O2S MolecularWeight: 491.6034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)N3CCC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)N3CCC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C30H25N3O2S/c1-35-24-13-11-21(12-14-24)25-19-27(22-7-3-2-4-8-22)32-30(26(25)20-31)36-18-16-29(34)33-17-15-23-9-5-6-10-28(23)33/h2-14,19H,15-18H2,1H3