2,7,7-trimethyl-N-(2-methylphenyl)-4-(4-methylsulfanylphenyl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxamide

Systemtic Name: 2,7,7-trimethyl-N-(2-methylphenyl)-4-(4-methylsulfanylphenyl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxamide Openeye Name: 2,7,7-trimethyl-4-(4-methylsulfanylphenyl)-N-(o-tolyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide CAS Name: 2,7,7-trimethyl-N-(2-methylphenyl)-4-[4-(methylthio)phenyl]-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide IUPAC Name: 2,7,7-trimethyl-N-(2-methylphenyl)-4-(4-methylsulfanylphenyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide Traditional Name: 5-keto-2,7,7-trimethyl-4-[4-(methylthio)phenyl]-N-(o-tolyl)-1,4,6,8-tetrahydroquinoline-3-carboxamide Formula: C27H30N2O2S MolecularWeight: 446.6043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(NC3=C(C2C4=CC=C(C=C4)SC)C(=O)CC(C3)(C)C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(NC3=C(C2C4=CC=C(C=C4)SC)C(=O)CC(C3)(C)C)C

InChI

InChI=1S/C27H30N2O2S/c1-16-8-6-7-9-20(16)29-26(31)23-17(2)28-21-14-27(3,4)15-22(30)25(21)24(23)18-10-12-19(32-5)13-11-18/h6-13,24,28H,14-15H2,1-5H3,(H,29,31)