2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C16H13BrN2O3S2 MolecularWeight: 425.32002

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CC4=C(C=C3Br)OCCO4)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CC4=C(C=C3Br)OCCO4)SC=C2

InChI

InChI=1S/C16H13BrN2O3S2/c1-19-15(20)10-2-5-23-14(10)18-16(19)24-8-9-6-12-13(7-11(9)17)22-4-3-21-12/h2,5-7H,3-4,8H2,1H3