2-methyl-3-sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol

Systemtic Name: 2-methyl-3-sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol Openeye Name: 2-methyl-3-sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol CAS Name: 3-mercapto-2-methyl-1-(1,2,4-triazol-1-yl)-2-butanol IUPAC Name: 2-methyl-3-sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol Traditional Name: 3-mercapto-2-methyl-1-(1,2,4-triazol-1-yl)butan-2-ol Formula: C7H13N3OS MolecularWeight: 187.26262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(CN1C=NC=N1)O)S

Isomeric SMILES

CC(C(C)(CN1C=NC=N1)O)S

InChI

InChI=1S/C7H13N3OS/c1-6(12)7(2,11)3-10-5-8-4-9-10/h4-6,11-12H,3H2,1-2H3