N-(4-acetamido-3-chloranyl-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-1-tosyl-isonipecotamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)NC(=O)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)NC(=O)C)Cl

InChI

InChI=1S/C21H24ClN3O4S/c1-14-3-6-18(7-4-14)30(28,29)25-11-9-16(10-12-25)21(27)24-17-5-8-20(19(22)13-17)23-15(2)26/h3-8,13,16H,9-12H2,1-2H3,(H,23,26)(H,24,27)