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

Systemtic Name: 6-chloranyl-2-[(6-methyl-1,3-benzodioxol-4-yl)methylsulfanyl]pyrimidin-4-amine Openeye Name: 6-chloro-2-[(6-methyl-1,3-benzodioxol-4-yl)methylsulfanyl]pyrimidin-4-amine CAS Name: 6-chloro-2-[(6-methyl-1,3-benzodioxol-4-yl)methylthio]-4-pyrimidinamine IUPAC Name: 6-chloro-2-[(6-methyl-1,3-benzodioxol-4-yl)methylsulfanyl]pyrimidin-4-amine Traditional Name: [6-chloro-2-[(6-methyl-1,3-benzodioxol-4-yl)methylthio]pyrimidin-4-yl]amine Formula: C13H12ClN3O2S MolecularWeight: 309.77128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)OCO2)CSC3=NC(=CC(=N3)Cl)N

Isomeric SMILES

CC1=CC(=C2C(=C1)OCO2)CSC3=NC(=CC(=N3)Cl)N

InChI

InChI=1S/C13H12ClN3O2S/c1-7-2-8(12-9(3-7)18-6-19-12)5-20-13-16-10(14)4-11(15)17-13/h2-4H,5-6H2,1H3,(H2,15,16,17)