4-(3-fluorophenyl)-3-(thiomorpholin-4-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-fluorophenyl)-3-(thiomorpholin-4-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-fluorophenyl)-3-(thiomorpholinomethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-fluorophenyl)-3-(thiomorpholin-4-ylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-fluorophenyl)-3-(thiomorpholin-4-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-fluorophenyl)-3-(thiomorpholinomethyl)-1H-1,2,4-triazole-5-thione Formula: C13H15FN4S2 MolecularWeight: 310.413403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1CC2=NNC(=S)N2C3=CC(=CC=C3)F

Isomeric SMILES

C1CSCCN1CC2=NNC(=S)N2C3=CC(=CC=C3)F

InChI

InChI=1S/C13H15FN4S2/c14-10-2-1-3-11(8-10)18-12(15-16-13(18)19)9-17-4-6-20-7-5-17/h1-3,8H,4-7,9H2,(H,16,19)