methyl 2-[[2-(4-chlorophenyl)phenyl]sulfanylmethyl]-5-phenyl-pentanoate

Systemtic Name: methyl 2-[[2-(4-chlorophenyl)phenyl]sulfanylmethyl]-5-phenyl-pentanoate Openeye Name: methyl 2-[[2-(4-chlorophenyl)phenyl]sulfanylmethyl]-5-phenyl-pentanoate CAS Name: 2-[[[2-(4-chlorophenyl)phenyl]thio]methyl]-5-phenylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-chlorophenyl)phenyl]sulfanylmethyl]-5-phenylpentanoate Traditional Name: 2-[[[2-(4-chlorophenyl)phenyl]thio]methyl]-5-phenyl-valeric acid methyl ester Formula: C25H25ClO2S MolecularWeight: 424.9828

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCC1=CC=CC=C1)CSC2=CC=CC=C2C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C(CCCC1=CC=CC=C1)CSC2=CC=CC=C2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H25ClO2S/c1-28-25(27)21(11-7-10-19-8-3-2-4-9-19)18-29-24-13-6-5-12-23(24)20-14-16-22(26)17-15-20/h2-6,8-9,12-17,21H,7,10-11,18H2,1H3