3-[(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(4-amino-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(4-aminothieno[2,3-d]pyrimidin-2-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C14H10N6OS2 MolecularWeight: 342.3988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NC(=C4C=CSC4=N3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=NC(=C4C=CSC4=N3)N

InChI

InChI=1S/C14H10N6OS2/c15-11-9-5-6-22-12(9)17-14(16-11)23-7-20-13(21)8-3-1-2-4-10(8)18-19-20/h1-6H,7H2,(H2,15,16,17)