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

Systemtic Name: 2-[(2R)-3-[(2-chlorophenyl)methoxy]-2-oxidanyl-propyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[(2R)-3-[(2-chlorophenyl)methoxy]-2-hydroxy-propyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[(2R)-3-[(2-chlorophenyl)methoxy]-2-hydroxypropyl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[(2R)-3-[(2-chlorophenyl)methoxy]-2-hydroxypropyl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[(2R)-3-(2-chlorobenzyl)oxy-2-hydroxy-propyl]thio]-4,6-dimethyl-nicotinonitrile Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(COCC2=CC=CC=C2Cl)O)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC[C@@H](COCC2=CC=CC=C2Cl)O)C

InChI

InChI=1S/C18H19ClN2O2S/c1-12-7-13(2)21-18(16(12)8-20)24-11-15(22)10-23-9-14-5-3-4-6-17(14)19/h3-7,15,22H,9-11H2,1-2H3/t15-/m1/s1