N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-1-(2-thenoyl)isonipecotamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H26N4O2S/c1-2-17-5-7-18(8-6-17)16-27-21(9-12-24-27)25-22(28)19-10-13-26(14-11-19)23(29)20-4-3-15-30-20/h3-9,12,15,19H,2,10-11,13-14,16H2,1H3,(H,25,28)