N-(4-acetamidophenyl)-5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-(4-acetamidophenyl)-5-chloro-3-methyl-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: N-(4-acetamidophenyl)-5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-(4-acetamidophenyl)-5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-(4-acetamidophenyl)-5-chloro-3-methyl-1-(4-methylbenzyl)pyrazole-4-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3=CC=C(C=C3)NC(=O)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3=CC=C(C=C3)NC(=O)C)Cl

InChI

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