2-ethylsulfanylethyl 4-(4-dimethylaminophenyl)-2-methylidene-5-oxidanylidene-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: 2-ethylsulfanylethyl 4-(4-dimethylaminophenyl)-2-methylidene-5-oxidanylidene-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: 2-ethylsulfanylethyl 4-(4-dimethylaminophenyl)-2-methylene-5-oxo-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-(4-dimethylaminophenyl)-2-methylene-5-oxo-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid 2-(ethylthio)ethyl ester IUPAC Name: 2-ethylsulfanylethyl 4-(4-dimethylaminophenyl)-2-methylidene-5-oxo-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-(4-dimethylaminophenyl)-5-keto-2-methylene-7-phenyl-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid 2-(ethylthio)ethyl ester Formula: C29H34N2O3S MolecularWeight: 490.65686

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC1=C)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCSCCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC1=C)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C29H34N2O3S/c1-5-35-16-15-34-29(33)26-19(2)30-24-17-22(20-9-7-6-8-10-20)18-25(32)28(24)27(26)21-11-13-23(14-12-21)31(3)4/h6-14,22,26-27,30H,2,5,15-18H2,1,3-4H3