4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]benzamide

Systemtic Name: 4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]benzamide Openeye Name: 4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]benzamide CAS Name: 4-[[3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoylamino]benzamide Traditional Name: 4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]benzamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H22N4O2/c1-14-19(15(2)25(24-14)18-6-4-3-5-7-18)12-13-20(26)23-17-10-8-16(9-11-17)21(22)27/h3-11H,12-13H2,1-2H3,(H2,22,27)(H,23,26)