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

Systemtic Name: (3S)-N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3S)-N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3S)-N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-keto-isochroman-3-carboxamide Formula: C23H16N2O3S MolecularWeight: 400.44974

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1[C@H](OC(=O)C2=CC=CC=C21)C(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H16N2O3S/c26-21(19-13-14-7-1-2-8-15(14)23(27)28-19)24-17-10-4-3-9-16(17)22-25-18-11-5-6-12-20(18)29-22/h1-12,19H,13H2,(H,24,26)/t19-/m0/s1