2-(2-thiophen-2-yl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoate

Systemtic Name: 2-(2-thiophen-2-yl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoate Openeye Name: 2-[2-(2-thienyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]acetate CAS Name: 2-(2-thiophen-2-yl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetate IUPAC Name: 2-(2-thiophen-2-yl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetate Traditional Name: 2-[2-(2-thienyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]acetate Formula: C15H14NO2S2- MolecularWeight: 304.40716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1C3=CC=CS3)CC(=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1C3=CC=CS3)CC(=O)[O-]

InChI

InChI=1S/C15H15NO2S2/c17-15(18)10-16-8-7-14(13-6-3-9-19-13)20-12-5-2-1-4-11(12)16/h1-6,9,14H,7-8,10H2,(H,17,18)/p-1