5-bromanyl-4,6-dimethyl-2-pyrimidin-2-ylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 5-bromanyl-4,6-dimethyl-2-pyrimidin-2-ylsulfanyl-pyridine-3-carbonitrile Openeye Name: 5-bromo-4,6-dimethyl-2-pyrimidin-2-ylsulfanyl-pyridine-3-carbonitrile CAS Name: 5-bromo-4,6-dimethyl-2-(2-pyrimidinylthio)-3-pyridinecarbonitrile IUPAC Name: 5-bromo-4,6-dimethyl-2-pyrimidin-2-ylsulfanylpyridine-3-carbonitrile Traditional Name: 5-bromo-4,6-dimethyl-2-(2-pyrimidylthio)nicotinonitrile Formula: C12H9BrN4S MolecularWeight: 321.19566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1Br)C)SC2=NC=CC=N2)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1Br)C)SC2=NC=CC=N2)C#N

InChI

InChI=1S/C12H9BrN4S/c1-7-9(6-14)11(17-8(2)10(7)13)18-12-15-4-3-5-16-12/h3-5H,1-2H3