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

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C16H23N3O6S2 MolecularWeight: 417.50032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O6S2/c1-4-25-16(22)11-9(2)12(13(17)20)26-15(11)18-14(21)10-5-7-19(8-6-10)27(3,23)24/h10H,4-8H2,1-3H3,(H2,17,20)(H,18,21)