5-(2,2-dimethylpropyl)-3-dodecan-2-ylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(2,2-dimethylpropyl)-3-dodecan-2-ylsulfanyl-1H-1,2,4-triazole Openeye Name: 5-(2,2-dimethylpropyl)-3-(1-methylundecylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(2,2-dimethylpropyl)-3-(dodecan-2-ylthio)-1H-1,2,4-triazole IUPAC Name: 5-(2,2-dimethylpropyl)-3-dodecan-2-ylsulfanyl-1H-1,2,4-triazole Traditional Name: 3-(1-methylundecylthio)-5-neopentyl-1H-1,2,4-triazole Formula: C19H37N3S MolecularWeight: 339.58218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)SC1=NNC(=N1)CC(C)(C)C

Isomeric SMILES

CCCCCCCCCCC(C)SC1=NNC(=N1)CC(C)(C)C

InChI

InChI=1S/C19H37N3S/c1-6-7-8-9-10-11-12-13-14-16(2)23-18-20-17(21-22-18)15-19(3,4)5/h16H,6-15H2,1-5H3,(H,20,21,22)