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

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-thiophen-3-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-(thiophene-3-carbonyl)piperidine-4-carboxamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-1-[oxo(3-thiophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1-(thiophene-3-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-1-(3-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=CSC=C4

Isomeric SMILES

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

InChI

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