N-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)phenyl]-5-chloro-3-methyl-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: N-[4-(2-amino-2-oxoethyl)phenyl]-5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)phenyl]-5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)phenyl]-5-chloro-3-methyl-1-(4-methylbenzyl)pyrazole-4-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN4O2/c1-13-3-5-16(6-4-13)12-26-20(22)19(14(2)25-26)21(28)24-17-9-7-15(8-10-17)11-18(23)27/h3-10H,11-12H2,1-2H3,(H2,23,27)(H,24,28)