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

Systemtic Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3S)-N-(1,3-benzothiazol-2-yl)-1-keto-isochroman-3-carboxamide Formula: C17H12N2O3S MolecularWeight: 324.35378

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1[C@H](OC(=O)C2=CC=CC=C21)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H12N2O3S/c20-15(19-17-18-12-7-3-4-8-14(12)23-17)13-9-10-5-1-2-6-11(10)16(21)22-13/h1-8,13H,9H2,(H,18,19,20)/t13-/m0/s1