2-[2-[3-(2-methyl-1,3-thiazol-4-yl)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]pentanoic acid

Systemtic Name: 2-[2-[3-(2-methyl-1,3-thiazol-4-yl)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]pentanoic acid Openeye Name: 2-[[2-[3-(2-methylthiazol-4-yl)-4-oxo-chromen-7-yl]oxyacetyl]amino]pentanoic acid CAS Name: 2-[[2-[[3-(2-methyl-4-thiazolyl)-4-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]pentanoic acid IUPAC Name: 2-[[2-[3-(2-methyl-1,3-thiazol-4-yl)-4-oxochromen-7-yl]oxyacetyl]amino]pentanoic acid Traditional Name: 2-[[2-[4-keto-3-(2-methylthiazol-4-yl)chromen-7-yl]oxyacetyl]amino]valeric acid Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CSC(=N3)C

Isomeric SMILES

CCCC(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CSC(=N3)C

InChI

InChI=1S/C20H20N2O6S/c1-3-4-15(20(25)26)22-18(23)9-27-12-5-6-13-17(7-12)28-8-14(19(13)24)16-10-29-11(2)21-16/h5-8,10,15H,3-4,9H2,1-2H3,(H,22,23)(H,25,26)