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

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-1-[(2-chlorophenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-1-[(2-chlorophenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-1-(2-chlorobenzyl)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=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H18BrClN4O2/c1-13-8-16(21)6-7-18(13)25-19(27)10-23-20(28)15-9-24-26(12-15)11-14-4-2-3-5-17(14)22/h2-9,12H,10-11H2,1H3,(H,23,28)(H,25,27)