2-[3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[3-[(2-methoxyphenyl)methoxy]-2-oxidanyl-propyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[(2-hydroxy-3-o-anisyloxy-propyl)thio]-4,6-dimethyl-nicotinonitrile Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(COCC2=CC=CC=C2OC)O)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(COCC2=CC=CC=C2OC)O)C

InChI

InChI=1S/C19H22N2O3S/c1-13-8-14(2)21-19(17(13)9-20)25-12-16(22)11-24-10-15-6-4-5-7-18(15)23-3/h4-8,16,22H,10-12H2,1-3H3