5-tert-butyl-4-phenyl-5H-1,2,3-thiadiazole-4-thiol

Systemtic Name: 5-tert-butyl-4-phenyl-5H-1,2,3-thiadiazole-4-thiol Openeye Name: 5-tert-butyl-4-phenyl-5H-thiadiazole-4-thiol CAS Name: 5-tert-butyl-4-phenyl-5H-thiadiazole-4-thiol IUPAC Name: 5-tert-butyl-4-phenyl-5H-thiadiazole-4-thiol Traditional Name: 5-tert-butyl-4-phenyl-5H-thiadiazole-4-thiol Formula: C12H16N2S2 MolecularWeight: 252.39884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C(N=NS1)(C2=CC=CC=C2)S

Isomeric SMILES

CC(C)(C)C1C(N=NS1)(C2=CC=CC=C2)S

InChI

InChI=1S/C12H16N2S2/c1-11(2,3)10-12(15,13-14-16-10)9-7-5-4-6-8-9/h4-8,10,15H,1-3H3