methyl 6-[(2-methoxy-4-methylsulfanyl-phenyl)carbonylamino]-3,4-dihydro-2H-quinoline-1-carboxylate

Systemtic Name: methyl 6-[(2-methoxy-4-methylsulfanyl-phenyl)carbonylamino]-3,4-dihydro-2H-quinoline-1-carboxylate Openeye Name: methyl 6-[(2-methoxy-4-methylsulfanyl-benzoyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylate CAS Name: 6-[[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid methyl ester IUPAC Name: methyl 6-[(2-methoxy-4-methylsulfanylbenzoyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylate Traditional Name: 6-[[2-methoxy-4-(methylthio)benzoyl]amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid methyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)NC2=CC3=C(C=C2)N(CCC3)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)NC2=CC3=C(C=C2)N(CCC3)C(=O)OC

InChI

InChI=1S/C20H22N2O4S/c1-25-18-12-15(27-3)7-8-16(18)19(23)21-14-6-9-17-13(11-14)5-4-10-22(17)20(24)26-2/h6-9,11-12H,4-5,10H2,1-3H3,(H,21,23)