2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-keto-ethyl]isoindoline-1,3-quinone Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H16N2O3S/c22-17(20-10-5-11-25-16-9-4-3-8-15(16)20)12-21-18(23)13-6-1-2-7-14(13)19(21)24/h1-4,6-9H,5,10-12H2