2-[[[4-(4-methanethioyloxyphenyl)phenyl]sulfonylamino]methoxy]-5-phenyl-pent-4-ynoic acid

Systemtic Name: 2-[[[4-(4-methanethioyloxyphenyl)phenyl]sulfonylamino]methoxy]-5-phenyl-pent-4-ynoic acid Openeye Name: 2-[[[4-(4-methanethioyloxyphenyl)phenyl]sulfonylamino]methoxy]-5-phenyl-pent-4-ynoic acid CAS Name: 2-[[[4-(4-methanethioyloxyphenyl)phenyl]sulfonylamino]methoxy]-5-phenyl-4-pentynoic acid IUPAC Name: 2-[[[4-(4-methanethioyloxyphenyl)phenyl]sulfonylamino]methoxy]-5-phenylpent-4-ynoic acid Traditional Name: 5-phenyl-2-[[[4-(4-thioformyloxyphenyl)phenyl]sulfonylamino]methoxy]pent-4-ynoic acid Formula: C25H21NO6S2 MolecularWeight: 495.56734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCC(C(=O)O)OCNS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC=S

Isomeric SMILES

C1=CC=C(C=C1)C#CCC(C(=O)O)OCNS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC=S

InChI

InChI=1S/C25H21NO6S2/c27-25(28)24(8-4-7-19-5-2-1-3-6-19)31-17-26-34(29,30)23-15-11-21(12-16-23)20-9-13-22(14-10-20)32-18-33/h1-3,5-6,9-16,18,24,26H,8,17H2,(H,27,28)