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

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[3-(cyclopropanecarbonylamino)benzyl]-3-(2-thienyl)pyrazole-4-carboxamide Formula: C26H24N4O2S MolecularWeight: 456.55936

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C26H24N4O2S/c31-25(20-11-12-20)28-21-9-4-8-19(14-21)15-27-26(32)22-17-30(16-18-6-2-1-3-7-18)29-24(22)23-10-5-13-33-23/h1-10,13-14,17,20H,11-12,15-16H2,(H,27,32)(H,28,31)