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

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C18H15BrN2O3S2 MolecularWeight: 451.3573

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC3=CC4=C(C=C3Br)OCCO4)SC=C2

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC3=CC4=C(C=C3Br)OCCO4)SC=C2

InChI

InChI=1S/C18H15BrN2O3S2/c1-2-4-21-17(22)12-3-7-25-16(12)20-18(21)26-10-11-8-14-15(9-13(11)19)24-6-5-23-14/h2-3,7-9H,1,4-6,10H2