N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methyl-3-methylsulfanyl-aniline hydrochloride

Systemtic Name: N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methyl-3-methylsulfanyl-aniline hydrochloride Openeye Name: N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methyl-3-methylsulfanyl-aniline hydrochloride CAS Name: N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methyl-3-(methylthio)aniline hydrochloride IUPAC Name: N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-methyl-3-methylsulfanylaniline hydrochloride Traditional Name: 2-imidazolin-2-ylmethyl-[2-methyl-3-(methylthio)phenyl]amine hydrochloride Formula: C12H18ClN3S MolecularWeight: 271.80942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SC)NCC2=NCCN2.Cl

Isomeric SMILES

CC1=C(C=CC=C1SC)NCC2=NCCN2.Cl

InChI

InChI=1S/C12H17N3S.ClH/c1-9-10(4-3-5-11(9)16-2)15-8-12-13-6-7-14-12;/h3-5,15H,6-8H2,1-2H3,(H,13,14);1H