1-[4-(2-methylpropyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]butan-1-amine

Systemtic Name: 1-[4-(2-methylpropyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]butan-1-amine Openeye Name: 1-(5-allylsulfanyl-4-isobutyl-1,2,4-triazol-3-yl)butan-1-amine CAS Name: 1-[4-(2-methylpropyl)-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]-1-butanamine IUPAC Name: 1-[4-(2-methylpropyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]butan-1-amine Traditional Name: 1-[5-(allylthio)-4-isobutyl-1,2,4-triazol-3-yl]butylamine Formula: C13H24N4S MolecularWeight: 268.42146

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NN=C(N1CC(C)C)SCC=C)N

Isomeric SMILES

CCCC(C1=NN=C(N1CC(C)C)SCC=C)N

InChI

InChI=1S/C13H24N4S/c1-5-7-11(14)12-15-16-13(18-8-6-2)17(12)9-10(3)4/h6,10-11H,2,5,7-9,14H2,1,3-4H3