O2-ethyl O4-propyl 3-methyl-5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-propyl 3-methyl-5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-propyl 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 O2-ethyl ester O4-propyl ester IUPAC Name: 2-O-ethyl 4-O-propyl 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 O2-ethyl ester O4-propyl ester Formula: C19H28N2O7S2 MolecularWeight: 460.56482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O7S2/c1-5-11-28-18(23)14-12(3)15(19(24)27-6-2)29-17(14)20-16(22)13-7-9-21(10-8-13)30(4,25)26/h13H,5-11H2,1-4H3,(H,20,22)