2-hexylsulfonyl-5-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyrimidine-7-carbonitrile

Systemtic Name: 2-hexylsulfonyl-5-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyrimidine-7-carbonitrile Openeye Name: 2-hexylsulfonyl-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidine-7-carbonitrile CAS Name: 2-hexylsulfonyl-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidine-7-carbonitrile IUPAC Name: 2-hexylsulfonyl-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidine-7-carbonitrile Traditional Name: 2-hexylsulfonyl-5-keto-[1,3,4]thiadiazolo[3,2-a]pyrimidine-7-carbonitrile Formula: C12H14N4O3S2 MolecularWeight: 326.39456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)C1=NN2C(=O)C=C(N=C2S1)C#N

Isomeric SMILES

CCCCCCS(=O)(=O)C1=NN2C(=O)C=C(N=C2S1)C#N

InChI

InChI=1S/C12H14N4O3S2/c1-2-3-4-5-6-21(18,19)12-15-16-10(17)7-9(8-13)14-11(16)20-12/h7H,2-6H2,1H3