4-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-ethanoyl-6-methyl-1H-pyrimidin-2-one

Systemtic Name: 4-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-ethanoyl-6-methyl-1H-pyrimidin-2-one Openeye Name: 5-acetyl-4-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-2-one CAS Name: 5-acetyl-4-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-6-methyl-1H-pyrimidin-2-one IUPAC Name: 5-acetyl-4-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-methyl-1H-pyrimidin-2-one Traditional Name: 5-acetyl-4-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-6-methyl-1H-pyrimidin-2-one Formula: C16H15ClN2O4S MolecularWeight: 366.8193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC2=C3C(=CC(=C2)Cl)COCO3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC2=C3C(=CC(=C2)Cl)COCO3)C(=O)C

InChI

InChI=1S/C16H15ClN2O4S/c1-8-13(9(2)20)15(19-16(21)18-8)24-6-11-4-12(17)3-10-5-22-7-23-14(10)11/h3-4H,5-7H2,1-2H3,(H,18,19,21)