4-[[3-ethyl-4-(3-phenylmethoxyphenyl)-1,3-thiazol-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[3-ethyl-4-(3-phenylmethoxyphenyl)-1,3-thiazol-2-ylidene]amino]benzoic acid Openeye Name: 4-[[4-(3-benzyloxyphenyl)-3-ethyl-thiazol-2-ylidene]amino]benzoic acid CAS Name: 4-[[3-ethyl-4-(3-phenylmethoxyphenyl)-2-thiazolylidene]amino]benzoic acid IUPAC Name: 4-[[3-ethyl-4-(3-phenylmethoxyphenyl)-1,3-thiazol-2-ylidene]amino]benzoic acid Traditional Name: 4-[[4-(3-benzoxyphenyl)-3-ethyl-4-thiazolin-2-ylidene]amino]benzoic acid Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CSC1=NC2=CC=C(C=C2)C(=O)O)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCN1C(=CSC1=NC2=CC=C(C=C2)C(=O)O)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3S/c1-2-27-23(17-31-25(27)26-21-13-11-19(12-14-21)24(28)29)20-9-6-10-22(15-20)30-16-18-7-4-3-5-8-18/h3-15,17H,2,16H2,1H3,(H,28,29)