3-heptadecyl-4-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-heptadecyl-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-heptadecyl-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-heptadecyl-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-heptadecyl-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-heptadecyl-4-methyl-1H-1,2,4-triazole-5-thione Formula: C20H39N3S MolecularWeight: 353.60876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NNC(=S)N1C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NNC(=S)N1C

InChI

InChI=1S/C20H39N3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22-20(24)23(19)2/h3-18H2,1-2H3,(H,22,24)