N-(3-methylbutyl)-1-(3-pyrrol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-(3-pyrrol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-isopentyl-1-(3-pyrrol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-(3-methylbutyl)-1-[oxo-[3-(1-pyrrolyl)-2-thiophenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-(3-methylbutyl)-1-(3-pyrrol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-isoamyl-1-(3-pyrrol-1-ylthiophene-2-carbonyl)isonipecotamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CCN(CC1)C(=O)C2=C(C=CS2)N3C=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)C1CCN(CC1)C(=O)C2=C(C=CS2)N3C=CC=C3

InChI

InChI=1S/C20H27N3O2S/c1-15(2)5-9-21-19(24)16-6-12-23(13-7-16)20(25)18-17(8-14-26-18)22-10-3-4-11-22/h3-4,8,10-11,14-16H,5-7,9,12-13H2,1-2H3,(H,21,24)