2-ethylsulfanylethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: 2-ethylsulfanylethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxidanylidene-chromen-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: 2-ethylsulfanylethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxo-chromen-3-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxo-1-benzopyran-3-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester IUPAC Name: 2-ethylsulfanylethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxochromen-3-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 7-(2-chlorophenyl)-5-keto-4-(4-keto-6-methyl-chromen-3-yl)-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester Formula: C31H30ClNO5S MolecularWeight: 564.0916

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCOC(=O)C1=C(NC2=C(C1C3=COC4=C(C3=O)C=C(C=C4)C)C(=O)CC(C2)C5=CC=CC=C5Cl)C

Isomeric SMILES

CCSCCOC(=O)C1=C(NC2=C(C1C3=COC4=C(C3=O)C=C(C=C4)C)C(=O)CC(C2)C5=CC=CC=C5Cl)C

InChI

InChI=1S/C31H30ClNO5S/c1-4-39-12-11-37-31(36)27-18(3)33-24-14-19(20-7-5-6-8-23(20)32)15-25(34)29(24)28(27)22-16-38-26-10-9-17(2)13-21(26)30(22)35/h5-10,13,16,19,28,33H,4,11-12,14-15H2,1-3H3