N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1-(3-chlorophenyl)-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1-(3-chlorophenyl)-5-methyl-pyrazole-4-carboxamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-1-(3-chlorophenyl)-5-methyl-pyrazole-4-carboxamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-1-(3-chlorophenyl)-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-1-(3-chlorophenyl)-5-methylpyrazole-4-carboxamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-1-(3-chlorophenyl)-5-methyl-pyrazole-4-carboxamide Formula: C20H18BrClN4O2 MolecularWeight: 461.73952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=C(N(N=C2)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=C(N(N=C2)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C20H18BrClN4O2/c1-12-8-14(21)6-7-18(12)25-19(27)11-23-20(28)17-10-24-26(13(17)2)16-5-3-4-15(22)9-16/h3-10H,11H2,1-2H3,(H,23,28)(H,25,27)