N-[4-(diethoxyphosphorylmethyl)phenyl]-4-(1,3-thiazol-4-yl)pyrimidin-2-amine

Systemtic Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-4-(1,3-thiazol-4-yl)pyrimidin-2-amine Openeye Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-4-thiazol-4-yl-pyrimidin-2-amine CAS Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-4-(4-thiazolyl)-2-pyrimidinamine IUPAC Name: N-[4-(diethoxyphosphorylmethyl)phenyl]-4-(1,3-thiazol-4-yl)pyrimidin-2-amine Traditional Name: [4-(diethoxyphosphorylmethyl)phenyl]-(4-thiazol-4-ylpyrimidin-2-yl)amine Formula: C18H21N4O3PS MolecularWeight: 404.423101

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CSC=N3)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CSC=N3)OCC

InChI

InChI=1S/C18H21N4O3PS/c1-3-24-26(23,25-4-2)11-14-5-7-15(8-6-14)21-18-19-10-9-16(22-18)17-12-27-13-20-17/h5-10,12-13H,3-4,11H2,1-2H3,(H,19,21,22)