5-hexylsulfinyl-1,3,4-thiadiazole-2-carbonitrile

Systemtic Name: 5-hexylsulfinyl-1,3,4-thiadiazole-2-carbonitrile Openeye Name: 5-hexylsulfinyl-1,3,4-thiadiazole-2-carbonitrile CAS Name: 5-hexylsulfinyl-1,3,4-thiadiazole-2-carbonitrile IUPAC Name: 5-hexylsulfinyl-1,3,4-thiadiazole-2-carbonitrile Traditional Name: 5-hexylsulfinyl-1,3,4-thiadiazole-2-carbonitrile Formula: C9H13N3OS2 MolecularWeight: 243.34902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)C1=NN=C(S1)C#N

Isomeric SMILES

CCCCCCS(=O)C1=NN=C(S1)C#N

InChI

InChI=1S/C9H13N3OS2/c1-2-3-4-5-6-15(13)9-12-11-8(7-10)14-9/h2-6H2,1H3