N-(3-methylsulfanylpropyl)-3-(1,2,4-triazol-4-yl)aniline

Systemtic Name: N-(3-methylsulfanylpropyl)-3-(1,2,4-triazol-4-yl)aniline Openeye Name: N-(3-methylsulfanylpropyl)-3-(1,2,4-triazol-4-yl)aniline CAS Name: N-[3-(methylthio)propyl]-3-(1,2,4-triazol-4-yl)aniline IUPAC Name: N-(3-methylsulfanylpropyl)-3-(1,2,4-triazol-4-yl)aniline Traditional Name: 3-(methylthio)propyl-[3-(1,2,4-triazol-4-yl)phenyl]amine Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC1=CC=CC(=C1)N2C=NN=C2

Isomeric SMILES

CSCCCNC1=CC=CC(=C1)N2C=NN=C2

InChI

InChI=1S/C12H16N4S/c1-17-7-3-6-13-11-4-2-5-12(8-11)16-9-14-15-10-16/h2,4-5,8-10,13H,3,6-7H2,1H3