3,3-dimethyl-1-[(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)sulfanyl]butan-2-one

Systemtic Name: 3,3-dimethyl-1-[(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)sulfanyl]butan-2-one Openeye Name: 3,3-dimethyl-1-[(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)sulfanyl]butan-2-one CAS Name: 3,3-dimethyl-1-[[5-(2-pyrazinyl)-1,3,4-thiadiazol-2-yl]thio]-2-butanone IUPAC Name: 3,3-dimethyl-1-[(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)sulfanyl]butan-2-one Traditional Name: 3,3-dimethyl-1-[(5-pyrazin-2-yl-1,3,4-thiadiazol-2-yl)thio]butan-2-one Formula: C12H14N4OS2 MolecularWeight: 294.39576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=C(S1)C2=NC=CN=C2

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=C(S1)C2=NC=CN=C2

InChI

InChI=1S/C12H14N4OS2/c1-12(2,3)9(17)7-18-11-16-15-10(19-11)8-6-13-4-5-14-8/h4-6H,7H2,1-3H3