2-azanyl-5-bromanyl-4-(4-methoxyphenyl)-6-methylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-5-bromanyl-4-(4-methoxyphenyl)-6-methylsulfanyl-pyridine-3-carbonitrile Openeye Name: 2-amino-5-bromo-4-(4-methoxyphenyl)-6-methylsulfanyl-pyridine-3-carbonitrile CAS Name: 2-amino-5-bromo-4-(4-methoxyphenyl)-6-(methylthio)-3-pyridinecarbonitrile IUPAC Name: 2-amino-5-bromo-4-(4-methoxyphenyl)-6-methylsulfanylpyridine-3-carbonitrile Traditional Name: 2-amino-5-bromo-4-(4-methoxyphenyl)-6-(methylthio)nicotinonitrile Formula: C14H12BrN3OS MolecularWeight: 350.23358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NC(=C2Br)SC)N)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NC(=C2Br)SC)N)C#N

InChI

InChI=1S/C14H12BrN3OS/c1-19-9-5-3-8(4-6-9)11-10(7-16)13(17)18-14(20-2)12(11)15/h3-6H,1-2H3,(H2,17,18)