methyl 2,7,7-trimethyl-4-(5-methyl-2-methylsulfanyl-thiophen-3-yl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: methyl 2,7,7-trimethyl-4-(5-methyl-2-methylsulfanyl-thiophen-3-yl)-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 2,7,7-trimethyl-4-(5-methyl-2-methylsulfanyl-3-thienyl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-4-[5-methyl-2-(methylthio)-3-thiophenyl]-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2,7,7-trimethyl-4-(5-methyl-2-methylsulfanylthiophen-3-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-[5-methyl-2-(methylthio)-3-thienyl]-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C20H25NO3S2 MolecularWeight: 391.5474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)SC)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(S1)SC)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC)C

InChI

InChI=1S/C20H25NO3S2/c1-10-7-12(19(25-6)26-10)16-15(18(23)24-5)11(2)21-13-8-20(3,4)9-14(22)17(13)16/h7,16,21H,8-9H2,1-6H3