5-bromanyl-4,6-dimethyl-2-(phenylmethylsulfanyl)pyrimidine

Systemtic Name: 5-bromanyl-4,6-dimethyl-2-(phenylmethylsulfanyl)pyrimidine Openeye Name: 2-benzylsulfanyl-5-bromo-4,6-dimethyl-pyrimidine CAS Name: 5-bromo-4,6-dimethyl-2-(phenylmethylthio)pyrimidine IUPAC Name: 2-benzylsulfanyl-5-bromo-4,6-dimethylpyrimidine Traditional Name: 2-(benzylthio)-5-bromo-4,6-dimethyl-pyrimidine Formula: C13H13BrN2S MolecularWeight: 309.22472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC2=CC=CC=C2)C)Br

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC2=CC=CC=C2)C)Br

InChI

InChI=1S/C13H13BrN2S/c1-9-12(14)10(2)16-13(15-9)17-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3