2-(4-chlorophenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)-2-methyl-propan-1-amine dihydrochloride

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)-2-methyl-propan-1-amine dihydrochloride Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)-2-methyl-propan-1-amine dihydrochloride CAS Name: 2-[(4-chlorophenyl)thio]-N-[3-(1-imidazolyl)propyl]-2-methyl-1-propanamine dihydrochloride IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)-2-methylpropan-1-amine dihydrochloride Traditional Name: [2-[(4-chlorophenyl)thio]-2-methyl-propyl]-(3-imidazol-1-ylpropyl)amine dihydrochloride Formula: C16H24Cl3N3S MolecularWeight: 396.80586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNCCCN1C=CN=C1)SC2=CC=C(C=C2)Cl.Cl.Cl

Isomeric SMILES

CC(C)(CNCCCN1C=CN=C1)SC2=CC=C(C=C2)Cl.Cl.Cl

InChI

InChI=1S/C16H22ClN3S.2ClH/c1-16(2,21-15-6-4-14(17)5-7-15)12-18-8-3-10-20-11-9-19-13-20;;/h4-7,9,11,13,18H,3,8,10,12H2,1-2H3;2*1H