2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethyl]sulfanyl-5-ethyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]thio]-5-ethyl-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanyl-5-ethyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-keto-ethyl]thio]-5-ethyl-6-methyl-1H-pyrimidin-4-one Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(=O)C2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(=O)C2=CC3=C(C=C2)OCCO3)C

InChI

InChI=1S/C17H18N2O4S/c1-3-12-10(2)18-17(19-16(12)21)24-9-13(20)11-4-5-14-15(8-11)23-7-6-22-14/h4-5,8H,3,6-7,9H2,1-2H3,(H,18,19,21)