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

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C15H11ClN2O3S2 MolecularWeight: 366.84244

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=C(C=CS4)C(=O)N3)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=C(C=CS4)C(=O)N3)Cl

InChI

InChI=1S/C15H11ClN2O3S2/c16-10-3-8-5-20-7-21-12(8)9(4-10)6-23-15-17-13(19)11-1-2-22-14(11)18-15/h1-4H,5-7H2,(H,17,18,19)