2-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-6-phenylsulfanyl-hex-4-ynoic acid

Systemtic Name: 2-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-6-phenylsulfanyl-hex-4-ynoic acid Openeye Name: 2-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-6-phenylsulfanyl-hex-4-ynoic acid CAS Name: 2-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-6-(phenylthio)-4-hexynoic acid IUPAC Name: 2-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-6-phenylsulfanylhex-4-ynoic acid Traditional Name: 2-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-6-(phenylthio)hex-4-ynoic acid Formula: C28H29NO7S2 MolecularWeight: 555.66236

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(CC#CCSC1=CC=CC=C1)(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

COCCOC(CC#CCSC1=CC=CC=C1)(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C28H29NO7S2/c1-34-19-20-36-28(27(30)31,18-6-7-21-37-25-8-4-3-5-9-25)29-38(32,33)26-16-12-23(13-17-26)22-10-14-24(35-2)15-11-22/h3-5,8-17,29H,18-21H2,1-2H3,(H,30,31)