N-(6-ethyl-1,3-benzothiazol-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-oxo-isochromane-3-carboxamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-keto-isochroman-3-carboxamide Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C19H16N2O3S/c1-2-11-7-8-14-16(9-11)25-19(20-14)21-17(22)15-10-12-5-3-4-6-13(12)18(23)24-15/h3-9,15H,2,10H2,1H3,(H,20,21,22)