ethyl 4-methyl-3-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-methyl-3-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]benzoate Openeye Name: ethyl 4-methyl-3-[[1-(2-thienylsulfonyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 4-methyl-3-[[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-[(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)amino]benzoate Traditional Name: 4-methyl-3-[[1-(2-thienylsulfonyl)isonipecotoyl]amino]benzoic acid ethyl ester Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O5S2/c1-3-27-20(24)16-7-6-14(2)17(13-16)21-19(23)15-8-10-22(11-9-15)29(25,26)18-5-4-12-28-18/h4-7,12-13,15H,3,8-11H2,1-2H3,(H,21,23)