5-bromanyl-N2-(4-methylsulfanylphenyl)-N4-prop-2-ynyl-pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N2-(4-methylsulfanylphenyl)-N4-prop-2-ynyl-pyrimidine-2,4-diamine Openeye Name: 5-bromo-N2-(4-methylsulfanylphenyl)-N4-prop-2-ynyl-pyrimidine-2,4-diamine CAS Name: 5-bromo-N2-[4-(methylthio)phenyl]-N4-prop-2-ynylpyrimidine-2,4-diamine IUPAC Name: 5-bromo-2-N-(4-methylsulfanylphenyl)-4-N-prop-2-ynylpyrimidine-2,4-diamine Traditional Name: [5-bromo-2-[4-(methylthio)anilino]pyrimidin-4-yl]-propargyl-amine Formula: C14H13BrN4S MolecularWeight: 349.24882

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC2=NC=C(C(=N2)NCC#C)Br

Isomeric SMILES

CSC1=CC=C(C=C1)NC2=NC=C(C(=N2)NCC#C)Br

InChI

InChI=1S/C14H13BrN4S/c1-3-8-16-13-12(15)9-17-14(19-13)18-10-4-6-11(20-2)7-5-10/h1,4-7,9H,8H2,2H3,(H2,16,17,18,19)