N-(phenylmethyl)-3-pyridin-4-ylsulfanyl-propan-1-amine dihydrochloride

Systemtic Name: N-(phenylmethyl)-3-pyridin-4-ylsulfanyl-propan-1-amine dihydrochloride Openeye Name: N-benzyl-3-(4-pyridylsulfanyl)propan-1-amine dihydrochloride CAS Name: N-(phenylmethyl)-3-(pyridin-4-ylthio)-1-propanamine dihydrochloride IUPAC Name: N-benzyl-3-pyridin-4-ylsulfanylpropan-1-amine dihydrochloride Traditional Name: benzyl-[3-(4-pyridylthio)propyl]amine dihydrochloride Formula: C15H20Cl2N2S MolecularWeight: 331.3037

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCCSC2=CC=NC=C2.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CNCCCSC2=CC=NC=C2.Cl.Cl

InChI

InChI=1S/C15H18N2S.2ClH/c1-2-5-14(6-3-1)13-17-9-4-12-18-15-7-10-16-11-8-15;;/h1-3,5-8,10-11,17H,4,9,12-13H2;2*1H