N-(4-azanyl-1-phenyl-pyrazol-3-yl)-4-diethoxyphosphoryl-benzamide

Systemtic Name: N-(4-azanyl-1-phenyl-pyrazol-3-yl)-4-diethoxyphosphoryl-benzamide Openeye Name: N-(4-amino-1-phenyl-pyrazol-3-yl)-4-diethoxyphosphoryl-benzamide CAS Name: N-(4-amino-1-phenyl-3-pyrazolyl)-4-diethoxyphosphorylbenzamide IUPAC Name: N-(4-amino-1-phenylpyrazol-3-yl)-4-diethoxyphosphorylbenzamide Traditional Name: N-(4-amino-1-phenyl-pyrazol-3-yl)-4-diethoxyphosphoryl-benzamide Formula: C20H23N4O4P MolecularWeight: 414.394781

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=C(C=C1)C(=O)NC2=NN(C=C2N)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOP(=O)(C1=CC=C(C=C1)C(=O)NC2=NN(C=C2N)C3=CC=CC=C3)OCC

InChI

InChI=1S/C20H23N4O4P/c1-3-27-29(26,28-4-2)17-12-10-15(11-13-17)20(25)22-19-18(21)14-24(23-19)16-8-6-5-7-9-16/h5-14H,3-4,21H2,1-2H3,(H,22,23,25)