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

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]isoindoline-1,3-quinone Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H18N2O2S/c22-18-14-6-1-2-7-15(14)19(23)21(18)12-11-20-10-5-13-24-17-9-4-3-8-16(17)20/h1-4,6-9H,5,10-13H2