7-methoxy-4-[4-(1,3-thiazol-2-ylcarbamoylamino)phenoxy]quinoline-6-carboxylic acid

Systemtic Name: 7-methoxy-4-[4-(1,3-thiazol-2-ylcarbamoylamino)phenoxy]quinoline-6-carboxylic acid Openeye Name: 7-methoxy-4-[4-(thiazol-2-ylcarbamoylamino)phenoxy]quinoline-6-carboxylic acid CAS Name: 7-methoxy-4-[4-[[oxo-(2-thiazolylamino)methyl]amino]phenoxy]-6-quinolinecarboxylic acid IUPAC Name: 7-methoxy-4-[4-(1,3-thiazol-2-ylcarbamoylamino)phenoxy]quinoline-6-carboxylic acid Traditional Name: 7-methoxy-4-[4-(thiazol-2-ylcarbamoylamino)phenoxy]quinoline-6-carboxylic acid Formula: C21H16N4O5S MolecularWeight: 436.44054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC=CC(=C2C=C1C(=O)O)OC3=CC=C(C=C3)NC(=O)NC4=NC=CS4

Isomeric SMILES

COC1=CC2=NC=CC(=C2C=C1C(=O)O)OC3=CC=C(C=C3)NC(=O)NC4=NC=CS4

InChI

InChI=1S/C21H16N4O5S/c1-29-18-11-16-14(10-15(18)19(26)27)17(6-7-22-16)30-13-4-2-12(3-5-13)24-20(28)25-21-23-8-9-31-21/h2-11H,1H3,(H,26,27)(H2,23,24,25,28)