methyl 5,5-diphenyl-2-pyridin-2-ylsulfanyl-pentanoate

Systemtic Name: methyl 5,5-diphenyl-2-pyridin-2-ylsulfanyl-pentanoate Openeye Name: methyl 5,5-diphenyl-2-(2-pyridylsulfanyl)pentanoate CAS Name: 5,5-diphenyl-2-(2-pyridinylthio)pentanoic acid methyl ester IUPAC Name: methyl 5,5-diphenyl-2-pyridin-2-ylsulfanylpentanoate Traditional Name: 5,5-diphenyl-2-(2-pyridylthio)valeric acid methyl ester Formula: C23H23NO2S MolecularWeight: 377.49922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=CC=CC=N3

Isomeric SMILES

COC(=O)C(CCC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=CC=CC=N3

InChI

InChI=1S/C23H23NO2S/c1-26-23(25)21(27-22-14-8-9-17-24-22)16-15-20(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-14,17,20-21H,15-16H2,1H3