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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3C(CC4=CC=CC=C43)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3[C@H](CC4=CC=CC=C43)C

InChI

InChI=1S/C23H21N3OS/c1-3-16-8-9-20-18(11-16)12-19(13-24)23(25-20)28-14-22(27)26-15(2)10-17-6-4-5-7-21(17)26/h4-9,11-12,15H,3,10,14H2,1-2H3/t15-/m0/s1