5-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]azanidylsulfonyl]-6-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 5-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]azanidylsulfonyl]-6-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 5-[(5-isobutyl-1,3,4-thiadiazol-2-yl)azanidylsulfonyl]-6-oxo-1H-pyrimidin-2-olate CAS Name: 5-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]azanidylsulfonyl]-6-oxo-1H-pyrimidin-2-olate IUPAC Name: 5-[[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]azanidylsulfonyl]-6-oxo-1H-pyrimidin-2-olate Traditional Name: 5-[(5-isobutyl-1,3,4-thiadiazol-2-yl)azanidylsulfonyl]-6-keto-1H-pyrimidin-2-olate Formula: C10H11N5O4S2-2 MolecularWeight: 329.35544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)[N-]S(=O)(=O)C2=CN=C(NC2=O)[O-]

Isomeric SMILES

CC(C)CC1=NN=C(S1)[N-]S(=O)(=O)C2=CN=C(NC2=O)[O-]

InChI

InChI=1S/C10H13N5O4S2/c1-5(2)3-7-13-14-10(20-7)15-21(18,19)6-4-11-9(17)12-8(6)16/h4-5H,3H2,1-2H3,(H3,11,12,14,15,16,17)/p-2