(3S)-6-bromanyl-1-oxidanylidene-N-(1,3-thiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3S)-6-bromanyl-1-oxidanylidene-N-(1,3-thiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3S)-6-bromo-1-oxo-N-thiazol-2-yl-isochromane-3-carboxamide CAS Name: (3S)-6-bromo-1-oxo-N-(2-thiazolyl)-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-6-bromo-1-oxo-N-(1,3-thiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3S)-6-bromo-1-keto-N-thiazol-2-yl-isochroman-3-carboxamide Formula: C13H9BrN2O3S MolecularWeight: 353.19116

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)Br)C(=O)NC3=NC=CS3

Isomeric SMILES

C1[C@H](OC(=O)C2=C1C=C(C=C2)Br)C(=O)NC3=NC=CS3

InChI

InChI=1S/C13H9BrN2O3S/c14-8-1-2-9-7(5-8)6-10(19-12(9)18)11(17)16-13-15-3-4-20-13/h1-5,10H,6H2,(H,15,16,17)/t10-/m0/s1