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

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: [2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]thieno[2,3-d]pyrimidin-4-yl]amine Formula: C15H12ClN3O2S2 MolecularWeight: 365.85768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NC(=C4C=CSC4=N3)N)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NC(=C4C=CSC4=N3)N)Cl

InChI

InChI=1S/C15H12ClN3O2S2/c16-10-3-8-5-20-7-21-12(8)9(4-10)6-23-15-18-13(17)11-1-2-22-14(11)19-15/h1-4H,5-7H2,(H2,17,18,19)