N-[4-[diethylamino-[(4-methylphenyl)amino]phosphoryl]-5-methyl-2-phenyl-pyrazol-3-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[diethylamino-[(4-methylphenyl)amino]phosphoryl]-5-methyl-2-phenyl-pyrazol-3-yl]-4-fluoranyl-benzamide Openeye Name: N-[4-[diethylamino-(4-methylanilino)phosphoryl]-5-methyl-2-phenyl-pyrazol-3-yl]-4-fluoro-benzamide CAS Name: N-[4-[diethylamino-(4-methylanilino)phosphoryl]-5-methyl-2-phenyl-3-pyrazolyl]-4-fluorobenzamide IUPAC Name: N-[4-[diethylamino-(4-methylanilino)phosphoryl]-5-methyl-2-phenylpyrazol-3-yl]-4-fluorobenzamide Traditional Name: N-[4-[diethylamino(p-toluidino)phosphoryl]-5-methyl-2-phenyl-pyrazol-3-yl]-4-fluoro-benzamide Formula: C28H31FN5O2P MolecularWeight: 519.550204

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)P(=O)(C1=C(N(N=C1C)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)F)NC4=CC=C(C=C4)C

Isomeric SMILES

CCN(CC)P(=O)(C1=C(N(N=C1C)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)F)NC4=CC=C(C=C4)C

InChI

InChI=1S/C28H31FN5O2P/c1-5-33(6-2)37(36,32-24-18-12-20(3)13-19-24)26-21(4)31-34(25-10-8-7-9-11-25)27(26)30-28(35)22-14-16-23(29)17-15-22/h7-19H,5-6H2,1-4H3,(H,30,35)(H,32,36)