3-butylsulfanyl-5-pyridin-4-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-butylsulfanyl-5-pyridin-4-yl-1,2,4-triazol-4-amine Openeye Name: 3-butylsulfanyl-5-(4-pyridyl)-1,2,4-triazol-4-amine CAS Name: 3-(butylthio)-5-pyridin-4-yl-1,2,4-triazol-4-amine IUPAC Name: 3-butylsulfanyl-5-pyridin-4-yl-1,2,4-triazol-4-amine Traditional Name: [3-(butylthio)-5-(4-pyridyl)-1,2,4-triazol-4-yl]amine Formula: C11H15N5S MolecularWeight: 249.3353

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1N)C2=CC=NC=C2

Isomeric SMILES

CCCCSC1=NN=C(N1N)C2=CC=NC=C2

InChI

InChI=1S/C11H15N5S/c1-2-3-8-17-11-15-14-10(16(11)12)9-4-6-13-7-5-9/h4-7H,2-3,8,12H2,1H3