3-[(4-methoxyphenyl)-diphenyl-methyl]sulfanyl-2-(naphthalen-2-ylsulfonylamino)propanoic acid

Systemtic Name: 3-[(4-methoxyphenyl)-diphenyl-methyl]sulfanyl-2-(naphthalen-2-ylsulfonylamino)propanoic acid Openeye Name: 3-[(4-methoxyphenyl)-diphenyl-methyl]sulfanyl-2-(2-naphthylsulfonylamino)propanoic acid CAS Name: 3-[[(4-methoxyphenyl)-diphenylmethyl]thio]-2-(2-naphthalenylsulfonylamino)propanoic acid IUPAC Name: 3-[(4-methoxyphenyl)-diphenylmethyl]sulfanyl-2-(naphthalen-2-ylsulfonylamino)propanoic acid Traditional Name: 3-[[(4-methoxyphenyl)-diphenyl-methyl]thio]-2-(2-naphthylsulfonylamino)propionic acid Formula: C33H29NO5S2 MolecularWeight: 583.71706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC(C(=O)O)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC(C(=O)O)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C33H29NO5S2/c1-39-29-19-17-28(18-20-29)33(26-12-4-2-5-13-26,27-14-6-3-7-15-27)40-23-31(32(35)36)34-41(37,38)30-21-16-24-10-8-9-11-25(24)22-30/h2-22,31,34H,23H2,1H3,(H,35,36)