1-(phenylmethyl)-N-[(3-pyrrolidin-1-ylcarbonylphenyl)methyl]-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-N-[(3-pyrrolidin-1-ylcarbonylphenyl)methyl]-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[[3-(pyrrolidine-1-carbonyl)phenyl]methyl]-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[[3-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[[3-(pyrrolidine-1-carbonyl)phenyl]methyl]-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[3-(pyrrolidine-1-carbonyl)benzyl]-3-(2-thienyl)pyrazole-4-carboxamide Formula: C27H26N4O2S MolecularWeight: 470.58594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CC=C2)CNC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CC=C2)CNC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

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