4-bromanyl-N-[4-[[(4-bromophenyl)amino]-methoxy-phosphoryl]-2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl]benzamide

Systemtic Name: 4-bromanyl-N-[4-[[(4-bromophenyl)amino]-methoxy-phosphoryl]-2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl]benzamide Openeye Name: 4-bromo-N-[4-[(4-bromoanilino)-methoxy-phosphoryl]-2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl]benzamide CAS Name: 4-bromo-N-[4-[(4-bromoanilino)-methoxyphosphoryl]-2-(2-cyanoethyl)-5-methyl-3-pyrazolyl]benzamide IUPAC Name: 4-bromo-N-[4-[(4-bromoanilino)-methoxyphosphoryl]-2-(2-cyanoethyl)-5-methylpyrazol-3-yl]benzamide Traditional Name: 4-bromo-N-[4-[(4-bromoanilino)-methoxy-phosphoryl]-2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl]benzamide Formula: C21H20Br2N5O3P MolecularWeight: 581.196961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1P(=O)(NC2=CC=C(C=C2)Br)OC)NC(=O)C3=CC=C(C=C3)Br)CCC#N

Isomeric SMILES

CC1=NN(C(=C1P(=O)(NC2=CC=C(C=C2)Br)OC)NC(=O)C3=CC=C(C=C3)Br)CCC#N

InChI

InChI=1S/C21H20Br2N5O3P/c1-14-19(32(30,31-2)27-18-10-8-17(23)9-11-18)20(28(26-14)13-3-12-24)25-21(29)15-4-6-16(22)7-5-15/h4-11H,3,13H2,1-2H3,(H,25,29)(H,27,30)