2-[2-oxidanyl-3-(2-phenylphenoxy)propyl]sulfanyl-4,6-diphenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-oxidanyl-3-(2-phenylphenoxy)propyl]sulfanyl-4,6-diphenyl-pyridine-3-carbonitrile Openeye Name: 2-[2-hydroxy-3-(2-phenylphenoxy)propyl]sulfanyl-4,6-diphenyl-pyridine-3-carbonitrile CAS Name: 2-[[2-hydroxy-3-(2-phenylphenoxy)propyl]thio]-4,6-diphenyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-hydroxy-3-(2-phenylphenoxy)propyl]sulfanyl-4,6-diphenylpyridine-3-carbonitrile Traditional Name: 2-[[2-hydroxy-3-(2-phenylphenoxy)propyl]thio]-4,6-diphenyl-nicotinonitrile Formula: C33H26N2O2S MolecularWeight: 514.63674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2OCC(CSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2OCC(CSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N)O

InChI

InChI=1S/C33H26N2O2S/c34-21-30-29(25-14-6-2-7-15-25)20-31(26-16-8-3-9-17-26)35-33(30)38-23-27(36)22-37-32-19-11-10-18-28(32)24-12-4-1-5-13-24/h1-20,27,36H,22-23H2