5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-methoxy-3-(methylsulfonylaminomethyl)benzoic acid

Systemtic Name: 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-methoxy-3-(methylsulfonylaminomethyl)benzoic acid Openeye Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-3-(methanesulfonamidomethyl)-2-methoxy-benzoic acid CAS Name: 5-[2-(3,4-diethoxyphenyl)-4-thiazolyl]-3-(methanesulfonamidomethyl)-2-methoxybenzoic acid IUPAC Name: 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-3-(methanesulfonamidomethyl)-2-methoxybenzoic acid Traditional Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-3-(methanesulfonamidomethyl)-2-methoxy-benzoic acid Formula: C23H26N2O7S2 MolecularWeight: 506.59174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C(C(=C3)CNS(=O)(=O)C)OC)C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C(C(=C3)CNS(=O)(=O)C)OC)C(=O)O)OCC

InChI

InChI=1S/C23H26N2O7S2/c1-5-31-19-8-7-14(11-20(19)32-6-2)22-25-18(13-33-22)15-9-16(12-24-34(4,28)29)21(30-3)17(10-15)23(26)27/h7-11,13,24H,5-6,12H2,1-4H3,(H,26,27)