2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4,6-dimethyl-nicotinonitrile Formula: C17H13BrN4OS MolecularWeight: 401.28032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=NC(=NO2)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=NC(=NO2)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C17H13BrN4OS/c1-10-6-11(2)20-17(14(10)8-19)24-9-15-21-16(22-23-15)12-4-3-5-13(18)7-12/h3-7H,9H2,1-2H3