6,7-dimethyl-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinoline-3-carbonitrile

Systemtic Name: 6,7-dimethyl-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinoline-3-carbonitrile Openeye Name: 6,7-dimethyl-2-[2-(2-methylindolin-1-yl)-2-oxo-ethyl]sulfanyl-quinoline-3-carbonitrile CAS Name: 6,7-dimethyl-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 6,7-dimethyl-2-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanylquinoline-3-carbonitrile Traditional Name: 2-[[2-keto-2-(2-methylindolin-1-yl)ethyl]thio]-6,7-dimethyl-quinoline-3-carbonitrile Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=CC(=C(C=C4C=C3C#N)C)C

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=CC(=C(C=C4C=C3C#N)C)C

InChI

InChI=1S/C23H21N3OS/c1-14-8-18-11-19(12-24)23(25-20(18)9-15(14)2)28-13-22(27)26-16(3)10-17-6-4-5-7-21(17)26/h4-9,11,16H,10,13H2,1-3H3