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

Systemtic Name: N-(5-methylhexan-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Openeye Name: N-(1,4-dimethylpentyl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline CAS Name: N-(5-methylhexan-2-yl)-4-(1H-1,2,4-triazol-5-ylthio)aniline IUPAC Name: N-(5-methylhexan-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanyl)aniline Traditional Name: 1,4-dimethylpentyl-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]amine Formula: C15H22N4S MolecularWeight: 290.42698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC1=CC=C(C=C1)SC2=NC=NN2

Isomeric SMILES

CC(C)CCC(C)NC1=CC=C(C=C1)SC2=NC=NN2

InChI

InChI=1S/C15H22N4S/c1-11(2)4-5-12(3)18-13-6-8-14(9-7-13)20-15-16-10-17-19-15/h6-12,18H,4-5H2,1-3H3,(H,16,17,19)