4-[(1,4,5-trimethylimidazol-2-yl)sulfanylmethyl]aniline

Systemtic Name: 4-[(1,4,5-trimethylimidazol-2-yl)sulfanylmethyl]aniline Openeye Name: 4-[(1,4,5-trimethylimidazol-2-yl)sulfanylmethyl]aniline CAS Name: 4-[[(1,4,5-trimethyl-2-imidazolyl)thio]methyl]aniline IUPAC Name: 4-[(1,4,5-trimethylimidazol-2-yl)sulfanylmethyl]aniline Traditional Name: [4-[[(1,4,5-trimethylimidazol-2-yl)thio]methyl]phenyl]amine Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC2=CC=C(C=C2)N)C)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC2=CC=C(C=C2)N)C)C

InChI

InChI=1S/C13H17N3S/c1-9-10(2)16(3)13(15-9)17-8-11-4-6-12(14)7-5-11/h4-7H,8,14H2,1-3H3