ethyl 3-methyl-5-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-[(1-mesyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C)C

InChI

InChI=1S/C19H22N2O5S2/c1-4-26-19(23)17-12(2)10-16(27-17)20-18(22)14-7-8-15-13(11-14)6-5-9-21(15)28(3,24)25/h7-8,10-11H,4-6,9H2,1-3H3,(H,20,22)