2-[(2R)-3-[(S)-(4-methylphenyl)sulfinyl]-2-oxidanyl-propyl]sulfanyl-4-phenyl-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(2R)-3-[(S)-(4-methylphenyl)sulfinyl]-2-oxidanyl-propyl]sulfanyl-4-phenyl-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(2R)-2-hydroxy-3-[(S)-p-tolylsulfinyl]propyl]sulfanyl-4-phenyl-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[[(2R)-2-hydroxy-3-[(S)-(4-methylphenyl)sulfinyl]propyl]thio]-4-phenyl-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(2R)-2-hydroxy-3-[(S)-(4-methylphenyl)sulfinyl]propyl]sulfanyl-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[[(2R)-2-hydroxy-3-[(S)-p-tolylsulfinyl]propyl]thio]-4-phenyl-6-(2-thienyl)nicotinonitrile Formula: C26H22N2O2S3 MolecularWeight: 490.66008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CC(CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CC=C4)C#N)O

Isomeric SMILES

CC1=CC=C(C=C1)[S@@](=O)C[C@@H](CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CC=C4)C#N)O

InChI

InChI=1S/C26H22N2O2S3/c1-18-9-11-21(12-10-18)33(30)17-20(29)16-32-26-23(15-27)22(19-6-3-2-4-7-19)14-24(28-26)25-8-5-13-31-25/h2-14,20,29H,16-17H2,1H3/t20-,33+/m1/s1