2-[[4-(3-ethoxycarbonyl-1-ethyl-4-oxidanylidene-quinolin-7-yl)-1,3-thiazol-2-yl]amino]ethanoic acid

Systemtic Name: 2-[[4-(3-ethoxycarbonyl-1-ethyl-4-oxidanylidene-quinolin-7-yl)-1,3-thiazol-2-yl]amino]ethanoic acid Openeye Name: 2-[[4-(3-ethoxycarbonyl-1-ethyl-4-oxo-7-quinolyl)thiazol-2-yl]amino]acetic acid CAS Name: 2-[[4-(3-ethoxycarbonyl-1-ethyl-4-oxo-7-quinolinyl)-2-thiazolyl]amino]acetic acid IUPAC Name: 2-[[4-(3-ethoxycarbonyl-1-ethyl-4-oxoquinolin-7-yl)-1,3-thiazol-2-yl]amino]acetic acid Traditional Name: 2-[[4-(3-carbethoxy-1-ethyl-4-keto-7-quinolyl)thiazol-2-yl]amino]acetic acid Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CSC(=N3)NCC(=O)O)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CSC(=N3)NCC(=O)O)C(=O)OCC

InChI

InChI=1S/C19H19N3O5S/c1-3-22-9-13(18(26)27-4-2)17(25)12-6-5-11(7-15(12)22)14-10-28-19(21-14)20-8-16(23)24/h5-7,9-10H,3-4,8H2,1-2H3,(H,20,21)(H,23,24)