1-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)carbonyl-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)carbonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carbonyl)piperidine-4-carboxamide CAS Name: 1-[[4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]-oxomethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(4,5-dimethyl-2-pyrrol-1-ylthiophene-3-carbonyl)piperidine-4-carboxamide Traditional Name: N-benzyl-1-(4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carbonyl)isonipecotamide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3)N4C=CC=C4)C

InChI

InChI=1S/C24H27N3O2S/c1-17-18(2)30-24(27-12-6-7-13-27)21(17)23(29)26-14-10-20(11-15-26)22(28)25-16-19-8-4-3-5-9-19/h3-9,12-13,20H,10-11,14-16H2,1-2H3,(H,25,28)