2-[(5-chloranyl-6-methyl-1,3-benzodioxol-4-yl)methylsulfanyl]-6-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 2-[(5-chloranyl-6-methyl-1,3-benzodioxol-4-yl)methylsulfanyl]-6-methylsulfanyl-pyrimidin-4-amine Openeye Name: 2-[(5-chloro-6-methyl-1,3-benzodioxol-4-yl)methylsulfanyl]-6-methylsulfanyl-pyrimidin-4-amine CAS Name: 2-[(5-chloro-6-methyl-1,3-benzodioxol-4-yl)methylthio]-6-(methylthio)-4-pyrimidinamine IUPAC Name: 2-[(5-chloro-6-methyl-1,3-benzodioxol-4-yl)methylsulfanyl]-6-methylsulfanylpyrimidin-4-amine Traditional Name: [2-[(5-chloro-6-methyl-1,3-benzodioxol-4-yl)methylthio]-6-(methylthio)pyrimidin-4-yl]amine Formula: C14H14ClN3O2S2 MolecularWeight: 355.86286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1Cl)CSC3=NC(=CC(=N3)SC)N)OCO2

Isomeric SMILES

CC1=CC2=C(C(=C1Cl)CSC3=NC(=CC(=N3)SC)N)OCO2

InChI

InChI=1S/C14H14ClN3O2S2/c1-7-3-9-13(20-6-19-9)8(12(7)15)5-22-14-17-10(16)4-11(18-14)21-2/h3-4H,5-6H2,1-2H3,(H2,16,17,18)