N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]-1-pyridin-4-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]-1-pyridin-4-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[(4-isopropylphenyl)-(2-thienyl)methyl]-1-(pyridine-4-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo(pyridin-4-yl)methyl]-N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-1-(pyridine-4-carbonyl)piperidine-4-carboxamide Traditional Name: 1-isonicotinoyl-N-[p-cumenyl(2-thienyl)methyl]isonipecotamide Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)C4=CC=NC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C26H29N3O2S/c1-18(2)19-5-7-20(8-6-19)24(23-4-3-17-32-23)28-25(30)21-11-15-29(16-12-21)26(31)22-9-13-27-14-10-22/h3-10,13-14,17-18,21,24H,11-12,15-16H2,1-2H3,(H,28,30)