2-chloranyl-N-[[3-chloranyl-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-4-yl]methyl]ethanamine

Systemtic Name: 2-chloranyl-N-[[3-chloranyl-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-4-yl]methyl]ethanamine Openeye Name: 2-chloro-N-[[3-chloro-2-(pyrimidin-2-ylsulfanylmethyl)-4-pyridyl]methyl]ethanamine CAS Name: 2-chloro-N-[[3-chloro-2-[(2-pyrimidinylthio)methyl]-4-pyridinyl]methyl]ethanamine IUPAC Name: 2-chloro-N-[[3-chloro-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-4-yl]methyl]ethanamine Traditional Name: 2-chloroethyl-[[3-chloro-2-[(2-pyrimidylthio)methyl]-4-pyridyl]methyl]amine Formula: C13H14Cl2N4S MolecularWeight: 329.24806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC2=NC=CC(=C2Cl)CNCCCl

Isomeric SMILES

C1=CN=C(N=C1)SCC2=NC=CC(=C2Cl)CNCCCl

InChI

InChI=1S/C13H14Cl2N4S/c14-3-7-16-8-10-2-6-17-11(12(10)15)9-20-13-18-4-1-5-19-13/h1-2,4-6,16H,3,7-9H2