3-methyl-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: 3-methyl-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: 3-methyl-N-[3-(2-methylthiazol-4-yl)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: 3-methyl-N-[3-(2-methyl-4-thiazolyl)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 3-methyl-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 1-keto-3-methyl-N-[3-(2-methylthiazol-4-yl)phenyl]isochroman-3-carboxamide Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C

InChI

InChI=1S/C21H18N2O3S/c1-13-22-18(12-27-13)14-7-5-8-16(10-14)23-20(25)21(2)11-15-6-3-4-9-17(15)19(24)26-21/h3-10,12H,11H2,1-2H3,(H,23,25)