1-(2-azanylethylsulfanyl)-2-(4-fluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol

Systemtic Name: 1-(2-azanylethylsulfanyl)-2-(4-fluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol Openeye Name: 1-(2-aminoethylsulfanyl)-2-(4-fluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol CAS Name: 1-(2-aminoethylthio)-2-(4-fluorophenyl)-3-(1,2,4-triazol-1-yl)-2-propanol IUPAC Name: 1-(2-aminoethylsulfanyl)-2-(4-fluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol Traditional Name: 1-(2-aminoethylthio)-2-(4-fluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol Formula: C13H17FN4OS MolecularWeight: 296.363683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CN2C=NC=N2)(CSCCN)O)F

Isomeric SMILES

C1=CC(=CC=C1C(CN2C=NC=N2)(CSCCN)O)F

InChI

InChI=1S/C13H17FN4OS/c14-12-3-1-11(2-4-12)13(19,8-20-6-5-15)7-18-10-16-9-17-18/h1-4,9-10,19H,5-8,15H2