1-(2-methylphenyl)carbonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-methylphenyl)carbonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Openeye Name: 1-(2-methylbenzoyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide CAS Name: 1-[(2-methylphenyl)-oxomethyl]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-methylbenzoyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-o-toluoyl-N-(4-pyrrolidinosulfonylphenyl)isonipecotamide Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H29N3O4S/c1-18-6-2-3-7-22(18)24(29)26-16-12-19(13-17-26)23(28)25-20-8-10-21(11-9-20)32(30,31)27-14-4-5-15-27/h2-3,6-11,19H,4-5,12-17H2,1H3,(H,25,28)