diethoxy-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane; naphthalene-1,4-dione

Systemtic Name: diethoxy-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane; naphthalene-1,4-dione Openeye Name: diethoxy-(2-isopropyl-6-methyl-pyrimidin-4-yl)oxy-thioxo-$l^{5}-phosphane; naphthalene-1,4-dione CAS Name: diethoxy-[(6-methyl-2-propan-2-yl-4-pyrimidinyl)oxy]-sulfanylidenephosphorane; naphthalene-1,4-dione IUPAC Name: diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane; naphthalene-1,4-dione Traditional Name: diethoxy-(2-isopropyl-6-methyl-pyrimidin-4-yl)oxy-thioxo-phosphorane; 1,4-naphthoquinone Formula: C22H27N2O5PS MolecularWeight: 462.498941

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C.C1=CC=C2C(=O)C=CC(=O)C2=C1

Isomeric SMILES

CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C.C1=CC=C2C(=O)C=CC(=O)C2=C1

InChI

InChI=1S/C12H21N2O3PS.C10H6O2/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4;11-9-5-6-10(12)8-4-2-1-3-7(8)9/h8-9H,6-7H2,1-5H3;1-6H