2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,7-dimethyl-quinoline-3-carbonitrile

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,7-dimethyl-quinoline-3-carbonitrile Openeye Name: 2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-5,7-dimethyl-quinoline-3-carbonitrile CAS Name: 2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-5,7-dimethyl-3-quinolinecarbonitrile IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-5,7-dimethylquinoline-3-carbonitrile Traditional Name: 2-[(2-indolin-1-yl-2-keto-ethyl)thio]-5,7-dimethyl-quinoline-3-carbonitrile Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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