propan-2-yl 5-aminocarbonyl-4-methyl-2-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: propan-2-yl 5-aminocarbonyl-4-methyl-2-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: isopropyl 5-carbamoyl-4-methyl-2-[(1-methylsulfonylpiperidine-4-carbonyl)amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-carbamoyl-4-methyl-2-[(1-methylsulfonylpiperidine-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[(1-mesylisonipecotoyl)amino]-4-methyl-thiophene-3-carboxylic acid isopropyl ester Formula: C17H25N3O6S2 MolecularWeight: 431.5269

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O6S2/c1-9(2)26-17(23)12-10(3)13(14(18)21)27-16(12)19-15(22)11-5-7-20(8-6-11)28(4,24)25/h9,11H,5-8H2,1-4H3,(H2,18,21)(H,19,22)