2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile Openeye Name: 2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile CAS Name: 2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-5,8-dimethyl-3-quinolinecarbonitrile IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-5,8-dimethylquinoline-3-carbonitrile Traditional Name: 2-[(2-indolin-1-yl-2-keto-ethyl)thio]-5,8-dimethyl-quinoline-3-carbonitrile Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCC4=CC=CC=C43)C#N

Isomeric SMILES

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCC4=CC=CC=C43)C#N

InChI

InChI=1S/C22H19N3OS/c1-14-7-8-15(2)21-18(14)11-17(12-23)22(24-21)27-13-20(26)25-10-9-16-5-3-4-6-19(16)25/h3-8,11H,9-10,13H2,1-2H3