1-(1-methylpyrrol-3-yl)sulfonyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(1-methylpyrrol-3-yl)sulfonyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide Openeye Name: N-[(1S)-1-methylbutyl]-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-[(1-methyl-3-pyrrolyl)sulfonyl]-N-[(2S)-pentan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(1-methylpyrrol-3-yl)sulfonyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-1-methylbutyl]-1-(1-methylpyrrol-3-yl)sulfonyl-isonipecotamide Formula: C16H27N3O3S MolecularWeight: 341.46888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CN(C=C2)C

Isomeric SMILES

CCC[C@H](C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CN(C=C2)C

InChI

InChI=1S/C16H27N3O3S/c1-4-5-13(2)17-16(20)14-6-10-19(11-7-14)23(21,22)15-8-9-18(3)12-15/h8-9,12-14H,4-7,10-11H2,1-3H3,(H,17,20)/t13-/m0/s1