2-[2-(4-bromanylphenoxy)ethylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-bromanylphenoxy)ethylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(4-bromophenoxy)ethylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile CAS Name: 2-[2-(4-bromophenoxy)ethylthio]-4,5,6-trimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(4-bromophenoxy)ethylsulfanyl]-4,5,6-trimethylpyridine-3-carbonitrile Traditional Name: 2-[2-(4-bromophenoxy)ethylthio]-4,5,6-trimethyl-nicotinonitrile Formula: C17H17BrN2OS MolecularWeight: 377.29868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCCOC2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCCOC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C17H17BrN2OS/c1-11-12(2)16(10-19)17(20-13(11)3)22-9-8-21-15-6-4-14(18)5-7-15/h4-7H,8-9H2,1-3H3