2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6,7-dimethyl-quinoline-3-carbonitrile

Systemtic Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6,7-dimethyl-quinoline-3-carbonitrile Openeye Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-6,7-dimethyl-quinoline-3-carbonitrile CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-6,7-dimethyl-3-quinolinecarbonitrile IUPAC Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-6,7-dimethylquinoline-3-carbonitrile Traditional Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-6,7-dimethyl-quinoline-3-carbonitrile Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)N3CCCC4=CC=CC=C43)C#N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)N3CCCC4=CC=CC=C43)C#N)C

InChI

InChI=1S/C23H21N3OS/c1-15-10-18-12-19(13-24)23(25-20(18)11-16(15)2)28-14-22(27)26-9-5-7-17-6-3-4-8-21(17)26/h3-4,6,8,10-12H,5,7,9,14H2,1-2H3