2-[[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]amino]-4-methyl-benzoic acid

Systemtic Name: 2-[[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]amino]-4-methyl-benzoic acid Openeye Name: 2-[[(5Z)-5-(2H-chromen-3-ylmethylene)-4-oxo-thiazol-2-yl]amino]-4-methyl-benzoic acid CAS Name: 2-[[(5Z)-5-(2H-1-benzopyran-3-ylmethylidene)-4-oxo-2-thiazolyl]amino]-4-methylbenzoic acid IUPAC Name: 2-[[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxo-1,3-thiazol-2-yl]amino]-4-methylbenzoic acid Traditional Name: 2-[[(5Z)-5-(2H-chromen-3-ylmethylene)-4-keto-2-thiazolin-2-yl]amino]-4-methyl-benzoic acid Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)O)NC2=NC(=O)C(=CC3=CC4=CC=CC=C4OC3)S2

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)O)NC2=NC(=O)/C(=C/C3=CC4=CC=CC=C4OC3)/S2

InChI

InChI=1S/C21H16N2O4S/c1-12-6-7-15(20(25)26)16(8-12)22-21-23-19(24)18(28-21)10-13-9-14-4-2-3-5-17(14)27-11-13/h2-10H,11H2,1H3,(H,25,26)(H,22,23,24)/b18-10-