1-[2-[(4-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[4-chloro-2-methyl-N-(p-tolylsulfonyl)anilino]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-(4-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(4-chloro-2-methyl-N-tosyl-anilino)acetyl]isonipecotamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O4S/c1-15-3-6-19(7-4-15)31(29,30)26(20-8-5-18(23)13-16(20)2)14-21(27)25-11-9-17(10-12-25)22(24)28/h3-8,13,17H,9-12,14H2,1-2H3,(H2,24,28)