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

Systemtic Name: N-[2-[(4-chlorophenyl)carbamoyl]phenyl]-2-methyl-5-propyl-pyrazole-3-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)carbamoyl]phenyl]-2-methyl-5-propyl-pyrazole-3-carboxamide CAS Name: N-[2-[(4-chloroanilino)-oxomethyl]phenyl]-2-methyl-5-propyl-3-pyrazolecarboxamide IUPAC Name: N-[2-[(4-chlorophenyl)carbamoyl]phenyl]-2-methyl-5-propylpyrazole-3-carboxamide Traditional Name: N-[2-[(4-chlorophenyl)carbamoyl]phenyl]-2-methyl-5-propyl-pyrazole-3-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)C(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCC1=NN(C(=C1)C(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H21ClN4O2/c1-3-6-16-13-19(26(2)25-16)21(28)24-18-8-5-4-7-17(18)20(27)23-15-11-9-14(22)10-12-15/h4-5,7-13H,3,6H2,1-2H3,(H,23,27)(H,24,28)