2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-(2-thienylmethyl)acetamide CAS Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-(4-keto-2,2-dimethyl-3H-1,5-benzothiazepin-5-yl)-N-(2-thenyl)acetamide Formula: C18H20N2O2S2 MolecularWeight: 360.4936

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCC3=CC=CS3)C

Isomeric SMILES

CC1(CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCC3=CC=CS3)C

InChI

InChI=1S/C18H20N2O2S2/c1-18(2)10-17(22)20(14-7-3-4-8-15(14)24-18)12-16(21)19-11-13-6-5-9-23-13/h3-9H,10-12H2,1-2H3,(H,19,21)