diethyl 3-methyl-5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[(1-mesylisonipecotoyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H26N2O7S2 MolecularWeight: 446.53824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C18H26N2O7S2/c1-5-26-17(22)13-11(3)14(18(23)27-6-2)28-16(13)19-15(21)12-7-9-20(10-8-12)29(4,24)25/h12H,5-10H2,1-4H3,(H,19,21)