N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-[(1-benzyl-3-phenyl-pyrazol-4-yl)methyl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C27H26N4O2S MolecularWeight: 470.58594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NCC3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NCC3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

InChI

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