4,6-dimethyl-2-(2-oxidanyl-3-phenoxy-propyl)sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-(2-oxidanyl-3-phenoxy-propyl)sulfanyl-pyridine-3-carbonitrile Openeye Name: 2-(2-hydroxy-3-phenoxy-propyl)sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[(2-hydroxy-3-phenoxypropyl)thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-(2-hydroxy-3-phenoxypropyl)sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[(2-hydroxy-3-phenoxy-propyl)thio]-4,6-dimethyl-nicotinonitrile Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(COC2=CC=CC=C2)O)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(COC2=CC=CC=C2)O)C

InChI

InChI=1S/C17H18N2O2S/c1-12-8-13(2)19-17(16(12)9-18)22-11-14(20)10-21-15-6-4-3-5-7-15/h3-8,14,20H,10-11H2,1-2H3