ethyl 5-ethyl-2-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[3-(1-piperidylsulfonyl)benzoyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[(3-piperidinosulfonylbenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C(=O)OCC

InChI

InChI=1S/C21H26N2O5S2/c1-3-16-14-18(21(25)28-4-2)20(29-16)22-19(24)15-9-8-10-17(13-15)30(26,27)23-11-6-5-7-12-23/h8-10,13-14H,3-7,11-12H2,1-2H3,(H,22,24)