4-(2-chlorophenyl)-3-heptyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-chlorophenyl)-3-heptyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-chlorophenyl)-3-heptyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-chlorophenyl)-3-heptyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-chlorophenyl)-3-heptyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-chlorophenyl)-3-heptyl-1H-1,2,4-triazole-5-thione Formula: C15H20ClN3S MolecularWeight: 309.8574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NNC(=S)N1C2=CC=CC=C2Cl

Isomeric SMILES

CCCCCCCC1=NNC(=S)N1C2=CC=CC=C2Cl

InChI

InChI=1S/C15H20ClN3S/c1-2-3-4-5-6-11-14-17-18-15(20)19(14)13-10-8-7-9-12(13)16/h7-10H,2-6,11H2,1H3,(H,18,20)