methyl 2-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[1-(2-thienylsulfonyl)piperidine-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 2-[[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 2-[[1-(2-thienylsulfonyl)isonipecotoyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C16H18N2O5S3 MolecularWeight: 414.51952

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H18N2O5S3/c1-23-16(20)12-6-10-25-15(12)17-14(19)11-4-7-18(8-5-11)26(21,22)13-3-2-9-24-13/h2-3,6,9-11H,4-5,7-8H2,1H3,(H,17,19)