N-[2-(azepan-1-yl)ethyl]-2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide CAS Name: N-[2-(1-azepanyl)ethyl]-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-2-(4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl)acetamide Formula: C19H27N3O2S MolecularWeight: 361.50158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNC(=O)CN2C(=O)CCSC3=CC=CC=C32

Isomeric SMILES

C1CCCN(CC1)CCNC(=O)CN2C(=O)CCSC3=CC=CC=C32

InChI

InChI=1S/C19H27N3O2S/c23-18(20-10-13-21-11-5-1-2-6-12-21)15-22-16-7-3-4-8-17(16)25-14-9-19(22)24/h3-4,7-8H,1-2,5-6,9-15H2,(H,20,23)