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

Systemtic Name: N-[2-[(3-methylphenyl)methyl]pyrazol-3-yl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[2-(m-tolylmethyl)pyrazol-3-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[2-[(3-methylphenyl)methyl]-3-pyrazolyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[2-[(3-methylphenyl)methyl]pyrazol-3-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[2-(3-methylbenzyl)pyrazol-3-yl]-1-(2-thenoyl)nipecotamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=CC=N2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=CC=N2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H24N4O2S/c1-16-5-2-6-17(13-16)14-26-20(9-10-23-26)24-21(27)18-7-3-11-25(15-18)22(28)19-8-4-12-29-19/h2,4-6,8-10,12-13,18H,3,7,11,14-15H2,1H3,(H,24,27)