2-[3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[3-(2,3-dihydroindol-1-yl)-3-oxidanylidene-propyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-(3-indolin-1-yl-3-oxo-propyl)sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[3-(2,3-dihydroindol-1-yl)-3-oxopropyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[(3-indolin-1-yl-3-keto-propyl)thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCCC(=O)N3CCC4=CC=CC=C43)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SCCC(=O)N3CCC4=CC=CC=C43)C#N

InChI

InChI=1S/C22H23N3OS/c1-15-6-7-19-17(12-15)13-18(14-23)22(24-19)27-11-9-21(26)25-10-8-16-4-2-3-5-20(16)25/h2-5,13,15H,6-12H2,1H3