3,5-dimethyl-1-phenyl-N-[3-(propanoylamino)phenyl]pyrazole-4-carboxamide

Systemtic Name: 3,5-dimethyl-1-phenyl-N-[3-(propanoylamino)phenyl]pyrazole-4-carboxamide Openeye Name: 3,5-dimethyl-1-phenyl-N-[3-(propanoylamino)phenyl]pyrazole-4-carboxamide CAS Name: 3,5-dimethyl-N-[3-(1-oxopropylamino)phenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3,5-dimethyl-1-phenyl-N-[3-(propanoylamino)phenyl]pyrazole-4-carboxamide Traditional Name: 3,5-dimethyl-1-phenyl-N-(3-propionamidophenyl)pyrazole-4-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N4O2/c1-4-19(26)22-16-9-8-10-17(13-16)23-21(27)20-14(2)24-25(15(20)3)18-11-6-5-7-12-18/h5-13H,4H2,1-3H3,(H,22,26)(H,23,27)