4-chloranyl-2-methyl-N-[4-(4-methylphenyl)carbonylphenyl]-5-propyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-2-methyl-N-[4-(4-methylphenyl)carbonylphenyl]-5-propyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-2-methyl-N-[4-(4-methylbenzoyl)phenyl]-5-propyl-pyrazole-3-carboxamide CAS Name: 4-chloro-2-methyl-N-[4-[(4-methylphenyl)-oxomethyl]phenyl]-5-propyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-2-methyl-N-[4-(4-methylbenzoyl)phenyl]-5-propylpyrazole-3-carboxamide Traditional Name: 4-chloro-2-methyl-5-propyl-N-(4-p-toluoylphenyl)pyrazole-3-carboxamide Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1Cl)C(=O)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCCC1=NN(C(=C1Cl)C(=O)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H22ClN3O2/c1-4-5-18-19(23)20(26(3)25-18)22(28)24-17-12-10-16(11-13-17)21(27)15-8-6-14(2)7-9-15/h6-13H,4-5H2,1-3H3,(H,24,28)