1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(4-phenylbutyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(4-phenylbutyl)piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(4-phenylbutyl)piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-(4-phenylbutyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-(4-phenylbutyl)piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(4-phenylbutyl)isonipecotamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NCCCCC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NCCCCC3=CC=CC=C3

InChI

InChI=1S/C22H30N4O4S/c1-25-16-19(15-20(25)21(23)27)31(29,30)26-13-10-18(11-14-26)22(28)24-12-6-5-9-17-7-3-2-4-8-17/h2-4,7-8,15-16,18H,5-6,9-14H2,1H3,(H2,23,27)(H,24,28)