2-(4-bromophenyl)-4-dimethoxyphosphoryl-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine

Systemtic Name: 2-(4-bromophenyl)-4-dimethoxyphosphoryl-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine Openeye Name: 2-(4-bromophenyl)-4-dimethoxyphosphoryl-N-(3-pyridylmethyl)oxazol-5-amine CAS Name: 2-(4-bromophenyl)-4-dimethoxyphosphoryl-N-(3-pyridinylmethyl)-5-oxazolamine IUPAC Name: 2-(4-bromophenyl)-4-dimethoxyphosphoryl-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine Traditional Name: [2-(4-bromophenyl)-4-dimethoxyphosphoryl-oxazol-5-yl]-(3-pyridylmethyl)amine Formula: C17H17BrN3O4P MolecularWeight: 438.212341

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1=C(OC(=N1)C2=CC=C(C=C2)Br)NCC3=CN=CC=C3)OC

Isomeric SMILES

COP(=O)(C1=C(OC(=N1)C2=CC=C(C=C2)Br)NCC3=CN=CC=C3)OC

InChI

InChI=1S/C17H17BrN3O4P/c1-23-26(22,24-2)17-16(20-11-12-4-3-9-19-10-12)25-15(21-17)13-5-7-14(18)8-6-13/h3-10,20H,11H2,1-2H3