3-(3-methylbutylsulfanyl)-5-pyridin-3-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-(3-methylbutylsulfanyl)-5-pyridin-3-yl-1,2,4-triazol-4-amine Openeye Name: 3-isopentylsulfanyl-5-(3-pyridyl)-1,2,4-triazol-4-amine CAS Name: 3-(3-methylbutylthio)-5-(3-pyridinyl)-1,2,4-triazol-4-amine IUPAC Name: 3-(3-methylbutylsulfanyl)-5-pyridin-3-yl-1,2,4-triazol-4-amine Traditional Name: [3-(isoamylthio)-5-(3-pyridyl)-1,2,4-triazol-4-yl]amine Formula: C12H17N5S MolecularWeight: 263.36188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NN=C(N1N)C2=CN=CC=C2

Isomeric SMILES

CC(C)CCSC1=NN=C(N1N)C2=CN=CC=C2

InChI

InChI=1S/C12H17N5S/c1-9(2)5-7-18-12-16-15-11(17(12)13)10-4-3-6-14-8-10/h3-4,6,8-9H,5,7,13H2,1-2H3