1-[2-[(3-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[3-chloro-2-methyl-N-(p-tolylsulfonyl)anilino]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-(3-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(3-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(3-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(=CC=C3)Cl)C

Isomeric SMILES

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

InChI

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