methyl (2R)-2-[[5-[2-(4-methoxyphenyl)ethynyl]thiophen-2-yl]sulfonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[[5-[2-(4-methoxyphenyl)ethynyl]thiophen-2-yl]sulfonylamino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[[5-[2-(4-methoxyphenyl)ethynyl]-2-thienyl]sulfonylamino]-3-phenyl-propanoate CAS Name: (2R)-2-[[5-[2-(4-methoxyphenyl)ethynyl]-2-thiophenyl]sulfonylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[5-[2-(4-methoxyphenyl)ethynyl]thiophen-2-yl]sulfonylamino]-3-phenylpropanoate Traditional Name: (2R)-2-[[5-[2-(4-methoxyphenyl)ethynyl]-2-thienyl]sulfonylamino]-3-phenyl-propionic acid methyl ester Formula: C23H21NO5S2 MolecularWeight: 455.54654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC2=CC=C(S2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C#CC2=CC=C(S2)S(=O)(=O)N[C@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H21NO5S2/c1-28-19-11-8-17(9-12-19)10-13-20-14-15-22(30-20)31(26,27)24-21(23(25)29-2)16-18-6-4-3-5-7-18/h3-9,11-12,14-15,21,24H,16H2,1-2H3/t21-/m1/s1