2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H17ClN2O3S2 MolecularWeight: 408.92218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSCC3=C4C(=CC(=C3)Cl)COCO4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSCC3=C4C(=CC(=C3)Cl)COCO4)C

InChI

InChI=1S/C18H17ClN2O3S2/c1-9-10(2)26-18-15(9)17(22)20-14(21-18)7-25-6-12-4-13(19)3-11-5-23-8-24-16(11)12/h3-4H,5-8H2,1-2H3,(H,20,21,22)