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

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-methoxy-quinoline-3-carbonitrile Openeye Name: 2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-6-methoxy-quinoline-3-carbonitrile CAS Name: 2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-6-methoxy-3-quinolinecarbonitrile IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-6-methoxyquinoline-3-carbonitrile Traditional Name: 2-[(2-indolin-1-yl-2-keto-ethyl)thio]-6-methoxy-quinoline-3-carbonitrile Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O2S/c1-26-17-6-7-18-15(11-17)10-16(12-22)21(23-18)27-13-20(25)24-9-8-14-4-2-3-5-19(14)24/h2-7,10-11H,8-9,13H2,1H3