4-(1,3-benzodioxol-5-ylmethylsulfanyl)-2,6-bis(chloranyl)-5-methyl-pyrimidine

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylsulfanyl)-2,6-bis(chloranyl)-5-methyl-pyrimidine Openeye Name: 4-(1,3-benzodioxol-5-ylmethylsulfanyl)-2,6-dichloro-5-methyl-pyrimidine CAS Name: 4-(1,3-benzodioxol-5-ylmethylthio)-2,6-dichloro-5-methylpyrimidine IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylsulfanyl)-2,6-dichloro-5-methylpyrimidine Traditional Name: 2,4-dichloro-5-methyl-6-(piperonylthio)pyrimidine Formula: C13H10Cl2N2O2S MolecularWeight: 329.2017

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1Cl)Cl)SCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(N=C(N=C1Cl)Cl)SCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H10Cl2N2O2S/c1-7-11(14)16-13(15)17-12(7)20-5-8-2-3-9-10(4-8)19-6-18-9/h2-4H,5-6H2,1H3