5-chloranyl-3-methyl-1-(2-methylpropyl)-N-(4-phenylazanylphenyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-(2-methylpropyl)-N-(4-phenylazanylphenyl)pyrazole-4-carboxamide Openeye Name: N-(4-anilinophenyl)-5-chloro-1-isobutyl-3-methyl-pyrazole-4-carboxamide CAS Name: N-(4-anilinophenyl)-5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-anilinophenyl)-5-chloro-3-methyl-1-(2-methylpropyl)pyrazole-4-carboxamide Traditional Name: N-(4-anilinophenyl)-5-chloro-1-isobutyl-3-methyl-pyrazole-4-carboxamide Formula: C21H23ClN4O MolecularWeight: 382.88652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)Cl)CC(C)C

InChI

InChI=1S/C21H23ClN4O/c1-14(2)13-26-20(22)19(15(3)25-26)21(27)24-18-11-9-17(10-12-18)23-16-7-5-4-6-8-16/h4-12,14,23H,13H2,1-3H3,(H,24,27)