3-methyl-4-[(1-methylimidazol-2-yl)methylsulfanyl]aniline

Systemtic Name: 3-methyl-4-[(1-methylimidazol-2-yl)methylsulfanyl]aniline Openeye Name: 3-methyl-4-[(1-methylimidazol-2-yl)methylsulfanyl]aniline CAS Name: 3-methyl-4-[(1-methyl-2-imidazolyl)methylthio]aniline IUPAC Name: 3-methyl-4-[(1-methylimidazol-2-yl)methylsulfanyl]aniline Traditional Name: [3-methyl-4-[(1-methylimidazol-2-yl)methylthio]phenyl]amine Formula: C12H15N3S MolecularWeight: 233.3326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SCC2=NC=CN2C

Isomeric SMILES

CC1=C(C=CC(=C1)N)SCC2=NC=CN2C

InChI

InChI=1S/C12H15N3S/c1-9-7-10(13)3-4-11(9)16-8-12-14-5-6-15(12)2/h3-7H,8,13H2,1-2H3