(3R)-N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-1-keto-isochroman-3-carboxamide Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3CC4=CC=CC=C4C(=O)O3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)[C@H]3CC4=CC=CC=C4C(=O)O3)OC

InChI

InChI=1S/C21H18N2O5S/c1-26-16-8-7-13(10-17(16)27-2)15-11-29-21(22-15)23-19(24)18-9-12-5-3-4-6-14(12)20(25)28-18/h3-8,10-11,18H,9H2,1-2H3,(H,22,23,24)/t18-/m1/s1