dimethyl 3-methyl-5-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[4-(1-piperidylsulfonyl)benzoyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[(4-piperidin-1-ylsulfonylbenzoyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(4-piperidinosulfonylbenzoyl)amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C21H24N2O7S2 MolecularWeight: 480.55446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)OC

InChI

InChI=1S/C21H24N2O7S2/c1-13-16(20(25)29-2)19(31-17(13)21(26)30-3)22-18(24)14-7-9-15(10-8-14)32(27,28)23-11-5-4-6-12-23/h7-10H,4-6,11-12H2,1-3H3,(H,22,24)