3-dodecylsulfanyl-5-propan-2-yl-1H-1,2,4-triazole

Systemtic Name: 3-dodecylsulfanyl-5-propan-2-yl-1H-1,2,4-triazole Openeye Name: 3-dodecylsulfanyl-5-isopropyl-1H-1,2,4-triazole CAS Name: 3-(dodecylthio)-5-propan-2-yl-1H-1,2,4-triazole IUPAC Name: 3-dodecylsulfanyl-5-propan-2-yl-1H-1,2,4-triazole Traditional Name: 5-isopropyl-3-(laurylthio)-1H-1,2,4-triazole Formula: C17H33N3S MolecularWeight: 311.52902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=NNC(=N1)C(C)C

Isomeric SMILES

CCCCCCCCCCCCSC1=NNC(=N1)C(C)C

InChI

InChI=1S/C17H33N3S/c1-4-5-6-7-8-9-10-11-12-13-14-21-17-18-16(15(2)3)19-20-17/h15H,4-14H2,1-3H3,(H,18,19,20)