4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide Openeye Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide CAS Name: 4-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]benzamide IUPAC Name: 4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide Traditional Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[3-(isobutyrylamino)benzyl]benzamide Formula: C23H25ClN4O2 MolecularWeight: 424.9232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C)C)Cl

InChI

InChI=1S/C23H25ClN4O2/c1-14(2)22(29)26-19-7-5-6-17(12-19)13-25-23(30)18-8-10-20(11-9-18)28-16(4)21(24)15(3)27-28/h5-12,14H,13H2,1-4H3,(H,25,30)(H,26,29)