5-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-2-(cyanomethylsulfanyl)-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 5-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-2-(cyanomethylsulfanyl)-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 5-[2-(4-bromophenyl)-2-oxo-ethyl]-2-(cyanomethylsulfanyl)-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 5-[2-(4-bromophenyl)-2-oxoethyl]-2-(cyanomethylthio)-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 5-[2-(4-bromophenyl)-2-oxoethyl]-2-(cyanomethylsulfanyl)-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 5-[2-(4-bromophenyl)-2-keto-ethyl]-2-(cyanomethylthio)-4,6-dimethyl-nicotinonitrile Formula: C18H14BrN3OS MolecularWeight: 400.29226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1CC(=O)C2=CC=C(C=C2)Br)C)SCC#N)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1CC(=O)C2=CC=C(C=C2)Br)C)SCC#N)C#N

InChI

InChI=1S/C18H14BrN3OS/c1-11-15(9-17(23)13-3-5-14(19)6-4-13)12(2)22-18(16(11)10-21)24-8-7-20/h3-6H,8-9H2,1-2H3