2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile

Systemtic Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile Openeye Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-5,8-dimethyl-quinoline-3-carbonitrile CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-5,8-dimethyl-3-quinolinecarbonitrile IUPAC Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-5,8-dimethylquinoline-3-carbonitrile Traditional Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-5,8-dimethyl-quinoline-3-carbonitrile Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCCC4=CC=CC=C43)C#N

Isomeric SMILES

CC1=C2C=C(C(=NC2=C(C=C1)C)SCC(=O)N3CCCC4=CC=CC=C43)C#N

InChI

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