2-[(3-bromophenyl)methylsulfonyl]-6-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 2-[(3-bromophenyl)methylsulfonyl]-6-methylsulfanyl-pyrimidin-4-amine Openeye Name: 2-[(3-bromophenyl)methylsulfonyl]-6-methylsulfanyl-pyrimidin-4-amine CAS Name: 2-[(3-bromophenyl)methylsulfonyl]-6-(methylthio)-4-pyrimidinamine IUPAC Name: 2-[(3-bromophenyl)methylsulfonyl]-6-methylsulfanylpyrimidin-4-amine Traditional Name: [2-(3-bromobenzyl)sulfonyl-6-(methylthio)pyrimidin-4-yl]amine Formula: C12H12BrN3O2S2 MolecularWeight: 374.27658

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1)N)S(=O)(=O)CC2=CC(=CC=C2)Br

Isomeric SMILES

CSC1=NC(=NC(=C1)N)S(=O)(=O)CC2=CC(=CC=C2)Br

InChI

InChI=1S/C12H12BrN3O2S2/c1-19-11-6-10(14)15-12(16-11)20(17,18)7-8-3-2-4-9(13)5-8/h2-6H,7H2,1H3,(H2,14,15,16)