3-(3-methoxyphenyl)-1-(phenylmethyl)-N-[3-(propanoylamino)phenyl]pyrazole-4-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-1-(phenylmethyl)-N-[3-(propanoylamino)phenyl]pyrazole-4-carboxamide Openeye Name: 1-benzyl-3-(3-methoxyphenyl)-N-[3-(propanoylamino)phenyl]pyrazole-4-carboxamide CAS Name: 3-(3-methoxyphenyl)-N-[3-(1-oxopropylamino)phenyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(3-methoxyphenyl)-N-[3-(propanoylamino)phenyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(3-methoxyphenyl)-N-(3-propionamidophenyl)pyrazole-4-carboxamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2=CN(N=C2C3=CC(=CC=C3)OC)CC4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2=CN(N=C2C3=CC(=CC=C3)OC)CC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3/c1-3-25(32)28-21-12-8-13-22(16-21)29-27(33)24-18-31(17-19-9-5-4-6-10-19)30-26(24)20-11-7-14-23(15-20)34-2/h4-16,18H,3,17H2,1-2H3,(H,28,32)(H,29,33)