3-[3-(1-methylimidazol-2-yl)sulfanylpropoxy]aniline

Systemtic Name: 3-[3-(1-methylimidazol-2-yl)sulfanylpropoxy]aniline Openeye Name: 3-[3-(1-methylimidazol-2-yl)sulfanylpropoxy]aniline CAS Name: 3-[3-[(1-methyl-2-imidazolyl)thio]propoxy]aniline IUPAC Name: 3-[3-(1-methylimidazol-2-yl)sulfanylpropoxy]aniline Traditional Name: [3-[3-[(1-methylimidazol-2-yl)thio]propoxy]phenyl]amine Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3OS/c1-16-7-6-15-13(16)18-9-3-8-17-12-5-2-4-11(14)10-12/h2,4-7,10H,3,8-9,14H2,1H3