3-[[4-methyl-5-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]propylazanium

Systemtic Name: 3-[[4-methyl-5-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]propylazanium Openeye Name: 3-[(5-isobutyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propylammonium CAS Name: 3-[[4-methyl-5-(2-methylpropyl)-1,2,4-triazol-3-yl]thio]propylammonium IUPAC Name: 3-[[4-methyl-5-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]propylazanium Traditional Name: 3-[(5-isobutyl-4-methyl-1,2,4-triazol-3-yl)thio]propylammonium Formula: C10H21N4S+ MolecularWeight: 229.36554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(N1C)SCCC[NH3+]

Isomeric SMILES

CC(C)CC1=NN=C(N1C)SCCC[NH3+]

InChI

InChI=1S/C10H20N4S/c1-8(2)7-9-12-13-10(14(9)3)15-6-4-5-11/h8H,4-7,11H2,1-3H3/p+1