methyl 4-methyl-3-[(3-piperidin-1-ylsulfonylthiophen-2-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[(3-piperidin-1-ylsulfonylthiophen-2-yl)carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[3-(1-piperidylsulfonyl)thiophene-2-carbonyl]amino]benzoate CAS Name: 4-methyl-3-[[oxo-[3-(1-piperidinylsulfonyl)-2-thiophenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(3-piperidin-1-ylsulfonylthiophene-2-carbonyl)amino]benzoate Traditional Name: 4-methyl-3-[(3-piperidinosulfonylthiophene-2-carbonyl)amino]benzoic acid methyl ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H22N2O5S2/c1-13-6-7-14(19(23)26-2)12-15(13)20-18(22)17-16(8-11-27-17)28(24,25)21-9-4-3-5-10-21/h6-8,11-12H,3-5,9-10H2,1-2H3,(H,20,22)