5-bromanyl-N-(4-methylphenyl)-2-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 5-bromanyl-N-(4-methylphenyl)-2-methylsulfanyl-pyrimidin-4-amine Openeye Name: 5-bromo-2-methylsulfanyl-N-(p-tolyl)pyrimidin-4-amine CAS Name: 5-bromo-N-(4-methylphenyl)-2-(methylthio)-4-pyrimidinamine IUPAC Name: 5-bromo-N-(4-methylphenyl)-2-methylsulfanylpyrimidin-4-amine Traditional Name: [5-bromo-2-(methylthio)pyrimidin-4-yl]-(p-tolyl)amine Formula: C12H12BrN3S MolecularWeight: 310.21278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC=C2Br)SC

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC=C2Br)SC

InChI

InChI=1S/C12H12BrN3S/c1-8-3-5-9(6-4-8)15-11-10(13)7-14-12(16-11)17-2/h3-7H,1-2H3,(H,14,15,16)