4-[3-(1,3-benzoxazol-6-yl)-3-[(2-methylphenyl)amino]-2-oxidanylidene-1-(1,3-thiazolidin-2-yl)propoxy]benzoic acid

Systemtic Name: 4-[3-(1,3-benzoxazol-6-yl)-3-[(2-methylphenyl)amino]-2-oxidanylidene-1-(1,3-thiazolidin-2-yl)propoxy]benzoic acid Openeye Name: 4-[3-(1,3-benzoxazol-6-yl)-3-(2-methylanilino)-2-oxo-1-thiazolidin-2-yl-propoxy]benzoic acid CAS Name: 4-[3-(1,3-benzoxazol-6-yl)-3-(2-methylanilino)-2-oxo-1-(2-thiazolidinyl)propoxy]benzoic acid IUPAC Name: 4-[3-(1,3-benzoxazol-6-yl)-3-(2-methylanilino)-2-oxo-1-(1,3-thiazolidin-2-yl)propoxy]benzoic acid Traditional Name: 4-[3-(1,3-benzoxazol-6-yl)-2-keto-3-(o-toluidino)-1-thiazolidin-2-yl-propoxy]benzoic acid Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(C2=CC3=C(C=C2)N=CO3)C(=O)C(C4NCCS4)OC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(C2=CC3=C(C=C2)N=CO3)C(=O)C(C4NCCS4)OC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C27H25N3O5S/c1-16-4-2-3-5-20(16)30-23(18-8-11-21-22(14-18)34-15-29-21)24(31)25(26-28-12-13-36-26)35-19-9-6-17(7-10-19)27(32)33/h2-11,14-15,23,25-26,28,30H,12-13H2,1H3,(H,32,33)