diethoxy-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane hydrate

Systemtic Name: diethoxy-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane hydrate Openeye Name: diethoxy-(2-isopropyl-6-methyl-pyrimidin-4-yl)oxy-thioxo-$l^{5}-phosphane hydrate CAS Name: diethoxy-[(6-methyl-2-propan-2-yl-4-pyrimidinyl)oxy]-sulfanylidenephosphorane hydrate IUPAC Name: diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane hydrate Traditional Name: diethoxy-(2-isopropyl-6-methyl-pyrimidin-4-yl)oxy-thioxo-phosphorane hydrate Formula: C12H23N2O4PS MolecularWeight: 322.360781

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C.O

Isomeric SMILES

CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C.O

InChI

InChI=1S/C12H21N2O3PS.H2O/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4;/h8-9H,6-7H2,1-5H3;1H2