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

Systemtic Name: N-phenethyl-1-(3-pyrrol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-phenethyl-1-(3-pyrrol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo-[3-(1-pyrrolyl)-2-thiophenyl]methyl]-N-phenethyl-4-piperidinecarboxamide IUPAC Name: N-phenethyl-1-(3-pyrrol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-phenethyl-1-(3-pyrrol-1-ylthiophene-2-carbonyl)isonipecotamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=CC=CC=C2)C(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=CC=CC=C2)C(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C23H25N3O2S/c27-22(24-12-8-18-6-2-1-3-7-18)19-9-15-26(16-10-19)23(28)21-20(11-17-29-21)25-13-4-5-14-25/h1-7,11,13-14,17,19H,8-10,12,15-16H2,(H,24,27)