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

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-ethoxy-quinoline-3-carbonitrile Openeye Name: 6-ethoxy-2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-quinoline-3-carbonitrile CAS Name: 2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-6-ethoxy-3-quinolinecarbonitrile IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-6-ethoxyquinoline-3-carbonitrile Traditional Name: 6-ethoxy-2-[(2-indolin-1-yl-2-keto-ethyl)thio]quinoline-3-carbonitrile Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H19N3O2S/c1-2-27-18-7-8-19-16(12-18)11-17(13-23)22(24-19)28-14-21(26)25-10-9-15-5-3-4-6-20(15)25/h3-8,11-12H,2,9-10,14H2,1H3