2-[[4-(3-chloranylpropylsulfanyl)-3-methyl-pyridin-2-yl]methylsulfanyl]pyrimidine dihydrochloride

Systemtic Name: 2-[[4-(3-chloranylpropylsulfanyl)-3-methyl-pyridin-2-yl]methylsulfanyl]pyrimidine dihydrochloride Openeye Name: 2-[[4-(3-chloropropylsulfanyl)-3-methyl-2-pyridyl]methylsulfanyl]pyrimidine dihydrochloride CAS Name: 2-[[4-(3-chloropropylthio)-3-methyl-2-pyridinyl]methylthio]pyrimidine dihydrochloride IUPAC Name: 2-[[4-(3-chloropropylsulfanyl)-3-methylpyridin-2-yl]methylsulfanyl]pyrimidine dihydrochloride Traditional Name: 2-[[4-(3-chloropropylthio)-3-methyl-2-pyridyl]methylthio]pyrimidine dihydrochloride Formula: C14H18Cl3N3S2 MolecularWeight: 398.80182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC=CC=N2)SCCCCl.Cl.Cl

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC=CC=N2)SCCCCl.Cl.Cl

InChI

InChI=1S/C14H16ClN3S2.2ClH/c1-11-12(10-20-14-17-6-3-7-18-14)16-8-4-13(11)19-9-2-5-15;;/h3-4,6-8H,2,5,9-10H2,1H3;2*1H