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

Systemtic Name: 2-(4-chlorophenyl)-3-sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol Openeye Name: 2-(4-chlorophenyl)-3-sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol CAS Name: 2-(4-chlorophenyl)-3-mercapto-1-(1,2,4-triazol-1-yl)-2-butanol IUPAC Name: 2-(4-chlorophenyl)-3-sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol Traditional Name: 2-(4-chlorophenyl)-3-mercapto-1-(1,2,4-triazol-1-yl)butan-2-ol Formula: C12H14ClN3OS MolecularWeight: 283.77706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=CC=C(C=C2)Cl)O)S

Isomeric SMILES

CC(C(CN1C=NC=N1)(C2=CC=C(C=C2)Cl)O)S

InChI

InChI=1S/C12H14ClN3OS/c1-9(18)12(17,6-16-8-14-7-15-16)10-2-4-11(13)5-3-10/h2-5,7-9,17-18H,6H2,1H3