5-butan-2-ylsulfonyl-1,3,4-thiadiazole-2-carbonitrile

Systemtic Name: 5-butan-2-ylsulfonyl-1,3,4-thiadiazole-2-carbonitrile Openeye Name: 5-sec-butylsulfonyl-1,3,4-thiadiazole-2-carbonitrile CAS Name: 5-butan-2-ylsulfonyl-1,3,4-thiadiazole-2-carbonitrile IUPAC Name: 5-butan-2-ylsulfonyl-1,3,4-thiadiazole-2-carbonitrile Traditional Name: 5-sec-butylsulfonyl-1,3,4-thiadiazole-2-carbonitrile Formula: C7H9N3O2S2 MolecularWeight: 231.29526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)S(=O)(=O)C1=NN=C(S1)C#N

Isomeric SMILES

CCC(C)S(=O)(=O)C1=NN=C(S1)C#N

InChI

InChI=1S/C7H9N3O2S2/c1-3-5(2)14(11,12)7-10-9-6(4-8)13-7/h5H,3H2,1-2H3