N-(2-methylbutyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline

Systemtic Name: N-(2-methylbutyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Openeye Name: N-(2-methylbutyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline CAS Name: N-(2-methylbutyl)-4-(1H-1,2,4-triazol-5-ylthio)aniline IUPAC Name: N-(2-methylbutyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Traditional Name: 2-methylbutyl-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]amine Formula: C13H18N4S MolecularWeight: 262.37382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC1=CC=C(C=C1)SC2=NC=NN2

Isomeric SMILES

CCC(C)CNC1=CC=C(C=C1)SC2=NC=NN2

InChI

InChI=1S/C13H18N4S/c1-3-10(2)8-14-11-4-6-12(7-5-11)18-13-15-9-16-17-13/h4-7,9-10,14H,3,8H2,1-2H3,(H,15,16,17)