2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxidanylidene-propyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxidanylidene-propyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxo-propyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[3-(3,4-dihydro-2H-quinolin-1-yl)-3-keto-propyl]thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCCC(=O)N3CCCC4=CC=CC=C43)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SCCC(=O)N3CCCC4=CC=CC=C43)C#N

InChI

InChI=1S/C23H25N3OS/c1-16-8-9-20-18(13-16)14-19(15-24)23(25-20)28-12-10-22(27)26-11-4-6-17-5-2-3-7-21(17)26/h2-3,5,7,14,16H,4,6,8-13H2,1H3