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

Systemtic Name: dimethyl 3-methyl-5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 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 dimethyl ester Formula: C16H22N2O7S2 MolecularWeight: 418.48508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C16H22N2O7S2/c1-9-11(15(20)24-2)14(26-12(9)16(21)25-3)17-13(19)10-5-7-18(8-6-10)27(4,22)23/h10H,5-8H2,1-4H3,(H,17,19)