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

Systemtic Name: N-[4-(4-chlorophenyl)carbonylphenyl]-2-methyl-5-propyl-pyrazole-3-carboxamide Openeye Name: N-[4-(4-chlorobenzoyl)phenyl]-2-methyl-5-propyl-pyrazole-3-carboxamide CAS Name: N-[4-[(4-chlorophenyl)-oxomethyl]phenyl]-2-methyl-5-propyl-3-pyrazolecarboxamide IUPAC Name: N-[4-(4-chlorobenzoyl)phenyl]-2-methyl-5-propylpyrazole-3-carboxamide Traditional Name: N-[4-(4-chlorobenzoyl)phenyl]-2-methyl-5-propyl-pyrazole-3-carboxamide Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H20ClN3O2/c1-3-4-18-13-19(25(2)24-18)21(27)23-17-11-7-15(8-12-17)20(26)14-5-9-16(22)10-6-14/h5-13H,3-4H2,1-2H3,(H,23,27)