2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(4-isopropyl-1,2,4-triazol-3-yl)thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C12H13N5OS2 MolecularWeight: 307.39452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

CC(C)N1C=NN=C1SCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C12H13N5OS2/c1-7(2)17-6-13-16-12(17)20-5-9-14-8-3-4-19-10(8)11(18)15-9/h3-4,6-7H,5H2,1-2H3,(H,14,15,18)