3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(4-methylphenyl)methyl]propan-1-amine hydrochloride

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(4-methylphenyl)methyl]propan-1-amine hydrochloride Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(p-tolylmethyl)propan-1-amine hydrochloride CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[(4-methylphenyl)methyl]-1-propanamine hydrochloride IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(4-methylphenyl)methyl]propan-1-amine hydrochloride Traditional Name: 3-[(4,6-dimethylpyrimidin-2-yl)thio]propyl-(4-methylbenzyl)amine hydrochloride Formula: C17H24ClN3S MolecularWeight: 337.91056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNCCCSC2=NC(=CC(=N2)C)C.Cl

Isomeric SMILES

CC1=CC=C(C=C1)CNCCCSC2=NC(=CC(=N2)C)C.Cl

InChI

InChI=1S/C17H23N3S.ClH/c1-13-5-7-16(8-6-13)12-18-9-4-10-21-17-19-14(2)11-15(3)20-17;/h5-8,11,18H,4,9-10,12H2,1-3H3;1H