N-[(4-methylsulfanylphenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine

Systemtic Name: N-[(4-methylsulfanylphenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine Openeye Name: N-[(4-methylsulfanylphenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine CAS Name: N-[[4-(methylthio)phenyl]methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine IUPAC Name: N-[(4-methylsulfanylphenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine Traditional Name: [4-(methylthio)benzyl]-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]amine Formula: C13H18N4S MolecularWeight: 262.37382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=CN1C)NCC2=CC=C(C=C2)SC

Isomeric SMILES

CC(C1=NN=CN1C)NCC2=CC=C(C=C2)SC

InChI

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