2-[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[[(2Z)-2-(2-pyrrolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C13H9N5O2S2 MolecularWeight: 331.37286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2NN=C(O2)SCC3=NC(=O)C4=C(N3)C=CS4)N=C1

Isomeric SMILES

C1=C/C(=C/2\NN=C(O2)SCC3=NC(=O)C4=C(N3)C=CS4)/N=C1

InChI

InChI=1S/C13H9N5O2S2/c19-11-10-7(3-5-21-10)15-9(16-11)6-22-13-18-17-12(20-13)8-2-1-4-14-8/h1-5,17H,6H2,(H,15,16,19)/b12-8-