[2-[[3,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-[[3,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(3,5-dichloroanilino)-2-oxo-1-phenyl-ethyl] 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid [2-(3,5-dichloroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3,5-dichloroanilino)-2-oxo-1-phenylethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid [2-(3,5-dichloroanilino)-2-keto-1-phenyl-ethyl] ester Formula: C24H22Cl2N2O5S2 MolecularWeight: 553.47788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC(=CC(=C3)Cl)Cl)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC(=CC(=C3)Cl)Cl)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C24H22Cl2N2O5S2/c25-18-13-19(26)15-20(14-18)27-23(29)22(16-5-2-1-3-6-16)33-24(30)17-8-10-28(11-9-17)35(31,32)21-7-4-12-34-21/h1-7,12-15,17,22H,8-11H2,(H,27,29)