4-[[5-ethyl-4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-ethyl-4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-ethyl-4-(2-oxochromen-3-yl)thiazol-2-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[5-ethyl-4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[5-ethyl-4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[5-ethyl-4-(2-ketochromen-3-yl)thiazol-2-yl]amino]-4-keto-butyric acid Formula: C18H16N2O5S MolecularWeight: 372.39504

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)NC(=O)CCC(=O)O)C2=CC3=CC=CC=C3OC2=O

Isomeric SMILES

CCC1=C(N=C(S1)NC(=O)CCC(=O)O)C2=CC3=CC=CC=C3OC2=O

InChI

InChI=1S/C18H16N2O5S/c1-2-13-16(20-18(26-13)19-14(21)7-8-15(22)23)11-9-10-5-3-4-6-12(10)25-17(11)24/h3-6,9H,2,7-8H2,1H3,(H,22,23)(H,19,20,21)