3-heptadecyl-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-heptadecyl-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-heptadecyl-1H-1,2,4-triazole-5-thione CAS Name: 3-heptadecyl-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-heptadecyl-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-heptadecyl-1H-1,2,4-triazole-5-thione Formula: C22H41N3S MolecularWeight: 379.64604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NNC(=S)N1CC=C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NNC(=S)N1CC=C

InChI

InChI=1S/C22H41N3S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23-24-22(26)25(21)20-4-2/h4H,2-3,5-20H2,1H3,(H,24,26)