ethyl 2-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-chloro-3-(1-piperidylsulfonyl)benzoyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-3-piperidin-1-ylsulfonylbenzoyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(4-chloro-3-piperidinosulfonyl-benzoyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H25ClN2O5S2 MolecularWeight: 533.0594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H25ClN2O5S2/c1-2-33-25(30)22-19(17-9-5-3-6-10-17)16-34-24(22)27-23(29)18-11-12-20(26)21(15-18)35(31,32)28-13-7-4-8-14-28/h3,5-6,9-12,15-16H,2,4,7-8,13-14H2,1H3,(H,27,29)