4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine

Systemtic Name: 4-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine Openeye Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine CAS Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-2,6-dimethylpyrimidine IUPAC Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-2,6-dimethylpyrimidine Traditional Name: 4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-2,6-dimethyl-pyrimidine Formula: C15H15BrN2O2S MolecularWeight: 367.2608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

CC1=CC(=NC(=N1)C)SCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C15H15BrN2O2S/c1-9-5-15(18-10(2)17-9)21-8-11-6-13-14(7-12(11)16)20-4-3-19-13/h5-7H,3-4,8H2,1-2H3