(3R)-N-[4-(2-methoxy-5-methyl-phenyl)-1,3-thiazol-2-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-N-[4-(2-methoxy-5-methyl-phenyl)-1,3-thiazol-2-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-[4-(2-methoxy-5-methyl-phenyl)thiazol-2-yl]-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-[4-(2-methoxy-5-methylphenyl)-2-thiazolyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-1-keto-N-[4-(2-methoxy-5-methyl-phenyl)thiazol-2-yl]isochroman-3-carboxamide Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)[C@H]3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H18N2O4S/c1-12-7-8-17(26-2)15(9-12)16-11-28-21(22-16)23-19(24)18-10-13-5-3-4-6-14(13)20(25)27-18/h3-9,11,18H,10H2,1-2H3,(H,22,23,24)/t18-/m1/s1