4,6-dimethyl-2-[(2R)-3-naphthalen-1-yloxy-2-oxidanyl-propyl]sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-[(2R)-3-naphthalen-1-yloxy-2-oxidanyl-propyl]sulfanyl-pyridine-3-carbonitrile Openeye Name: 2-[(2R)-2-hydroxy-3-(1-naphthyloxy)propyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[(2R)-2-hydroxy-3-(1-naphthalenyloxy)propyl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[(2R)-2-hydroxy-3-naphthalen-1-yloxypropyl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[(2R)-2-hydroxy-3-(1-naphthoxy)propyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(COC2=CC=CC3=CC=CC=C32)O)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC[C@@H](COC2=CC=CC3=CC=CC=C32)O)C

InChI

InChI=1S/C21H20N2O2S/c1-14-10-15(2)23-21(19(14)11-22)26-13-17(24)12-25-20-9-5-7-16-6-3-4-8-18(16)20/h3-10,17,24H,12-13H2,1-2H3/t17-/m1/s1