N-butyl-1-(1-methylpyrrol-3-yl)sulfonyl-N-phenyl-piperidine-4-carboxamide

Systemtic Name: N-butyl-1-(1-methylpyrrol-3-yl)sulfonyl-N-phenyl-piperidine-4-carboxamide Openeye Name: N-butyl-1-(1-methylpyrrol-3-yl)sulfonyl-N-phenyl-piperidine-4-carboxamide CAS Name: N-butyl-1-[(1-methyl-3-pyrrolyl)sulfonyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: N-butyl-1-(1-methylpyrrol-3-yl)sulfonyl-N-phenylpiperidine-4-carboxamide Traditional Name: N-butyl-1-(1-methylpyrrol-3-yl)sulfonyl-N-phenyl-isonipecotamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O3S/c1-3-4-13-24(19-8-6-5-7-9-19)21(25)18-10-15-23(16-11-18)28(26,27)20-12-14-22(2)17-20/h5-9,12,14,17-18H,3-4,10-11,13,15-16H2,1-2H3