N-[1-(phenylcarbonyl)piperidin-4-yl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(phenylcarbonyl)piperidin-4-yl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-(1-benzoyl-4-piperidyl)-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(1-benzoyl-4-piperidinyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-(1-benzoylpiperidin-4-yl)-1-benzyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-(1-benzoyl-4-piperidyl)-1-benzyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C27H26N4O2S MolecularWeight: 470.58594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O2S/c32-26(28-22-13-15-30(16-14-22)27(33)21-10-5-2-6-11-21)23-19-31(18-20-8-3-1-4-9-20)29-25(23)24-12-7-17-34-24/h1-12,17,19,22H,13-16,18H2,(H,28,32)