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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C

InChI

InChI=1S/C22H30N4O4S/c1-3-4-12-26(18-8-6-5-7-9-18)22(28)17-10-13-25(14-11-17)31(29,30)19-15-20(21(23)27)24(2)16-19/h5-9,15-17H,3-4,10-14H2,1-2H3,(H2,23,27)