2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4,5,6-trimethyl-pyrimidine

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4,5,6-trimethyl-pyrimidine Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4,5,6-trimethyl-pyrimidine CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4,5,6-trimethylpyrimidine IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-4,5,6-trimethylpyrimidine Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-4,5,6-trimethyl-pyrimidine Formula: C16H17BrN2O2S MolecularWeight: 381.28738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC2=CC3=C(C=C2Br)OCCO3)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC2=CC3=C(C=C2Br)OCCO3)C

InChI

InChI=1S/C16H17BrN2O2S/c1-9-10(2)18-16(19-11(9)3)22-8-12-6-14-15(7-13(12)17)21-5-4-20-14/h6-7H,4-5,8H2,1-3H3