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

Systemtic Name: ethyl 5-phenyl-3-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-phenyl-3-[[3-(1-piperidylsulfonyl)benzoyl]amino]thiophene-2-carboxylate CAS Name: 3-[[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-3-[(3-piperidin-1-ylsulfonylbenzoyl)amino]thiophene-2-carboxylate Traditional Name: 5-phenyl-3-[(3-piperidinosulfonylbenzoyl)amino]thiophene-2-carboxylic acid ethyl ester Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H26N2O5S2/c1-2-32-25(29)23-21(17-22(33-23)18-10-5-3-6-11-18)26-24(28)19-12-9-13-20(16-19)34(30,31)27-14-7-4-8-15-27/h3,5-6,9-13,16-17H,2,4,7-8,14-15H2,1H3,(H,26,28)