N-[2-(cyclohexen-1-yl)ethyl]-2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(2,2-dimethyl-4-oxidanylidene-3H-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(2,2-dimethyl-4-oxo-3H-1,5-benzothiazepin-5-yl)acetamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-keto-2,2-dimethyl-3H-1,5-benzothiazepin-5-yl)acetamide Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCCC3=CCCCC3)C

Isomeric SMILES

CC1(CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCCC3=CCCCC3)C

InChI

InChI=1S/C21H28N2O2S/c1-21(2)14-20(25)23(17-10-6-7-11-18(17)26-21)15-19(24)22-13-12-16-8-4-3-5-9-16/h6-8,10-11H,3-5,9,12-15H2,1-2H3,(H,22,24)