1-[4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[4-[(3-chloro-N-methylsulfonyl-anilino)methyl]benzoyl]piperidine-4-carboxamide CAS Name: 1-[[4-[(3-chloro-N-methylsulfonylanilino)methyl]phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-[(3-chloro-N-methylsulfonylanilino)methyl]benzoyl]piperidine-4-carboxamide Traditional Name: 1-[4-[(3-chloro-N-mesyl-anilino)methyl]benzoyl]isonipecotamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)N)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H24ClN3O4S/c1-30(28,29)25(19-4-2-3-18(22)13-19)14-15-5-7-17(8-6-15)21(27)24-11-9-16(10-12-24)20(23)26/h2-8,13,16H,9-12,14H2,1H3,(H2,23,26)