N-(3-methylbutyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline

Systemtic Name: N-(3-methylbutyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Openeye Name: N-isopentyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline CAS Name: N-(3-methylbutyl)-4-(1H-1,2,4-triazol-5-ylthio)aniline IUPAC Name: N-(3-methylbutyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Traditional Name: isoamyl-[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:

CC(C)CCNC1=CC=C(C=C1)SC2=NC=NN2

Isomeric SMILES

CC(C)CCNC1=CC=C(C=C1)SC2=NC=NN2

InChI

InChI=1S/C13H18N4S/c1-10(2)7-8-14-11-3-5-12(6-4-11)18-13-15-9-16-17-13/h3-6,9-10,14H,7-8H2,1-2H3,(H,15,16,17)