7,7-dimethyl-5-oxidanylidene-2-phenacylsulfanyl-4-thiophen-2-yl-1,4,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 7,7-dimethyl-5-oxidanylidene-2-phenacylsulfanyl-4-thiophen-2-yl-1,4,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 7,7-dimethyl-5-oxo-2-phenacylsulfanyl-4-(2-thienyl)-1,4,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: 7,7-dimethyl-5-oxo-2-(phenacylthio)-4-thiophen-2-yl-1,4,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 7,7-dimethyl-5-oxo-2-phenacylsulfanyl-4-thiophen-2-yl-1,4,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 5-keto-7,7-dimethyl-2-(phenacylthio)-4-(2-thienyl)-1,4,6,8-tetrahydroquinoline-3-carbonitrile Formula: C24H22N2O2S2 MolecularWeight: 434.57368

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2)SCC(=O)C3=CC=CC=C3)C#N)C4=CC=CS4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2)SCC(=O)C3=CC=CC=C3)C#N)C4=CC=CS4)C(=O)C1)C

InChI

InChI=1S/C24H22N2O2S2/c1-24(2)11-17-22(18(27)12-24)21(20-9-6-10-29-20)16(13-25)23(26-17)30-14-19(28)15-7-4-3-5-8-15/h3-10,21,26H,11-12,14H2,1-2H3