3-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propoxy]aniline

Systemtic Name: 3-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propoxy]aniline Openeye Name: 3-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propoxy]aniline CAS Name: 3-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]propoxy]aniline IUPAC Name: 3-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propoxy]aniline Traditional Name: [3-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]propoxy]phenyl]amine Formula: C12H16N4OS MolecularWeight: 264.34664

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCCOC2=CC=CC(=C2)N

Isomeric SMILES

CN1C=NN=C1SCCCOC2=CC=CC(=C2)N

InChI

InChI=1S/C12H16N4OS/c1-16-9-14-15-12(16)18-7-3-6-17-11-5-2-4-10(13)8-11/h2,4-5,8-9H,3,6-7,13H2,1H3