6,7,10-trimethyl-N-(3-morpholin-4-ylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 6,7,10-trimethyl-N-(3-morpholin-4-ylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 6,7,10-trimethyl-N-(3-morpholinopropyl)benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 6,7,10-trimethyl-N-[3-(4-morpholinyl)propyl]-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 6,7,10-trimethyl-N-(3-morpholin-4-ylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 6,7,10-trimethyl-N-(3-morpholinopropyl)benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C24H29N3O2S MolecularWeight: 423.57096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC3=C(C=CC(=C3)C(=O)NCCCN4CCOCC4)SC2=C(C=C1)C)C

Isomeric SMILES

CC1=C2C(=NC3=C(C=CC(=C3)C(=O)NCCCN4CCOCC4)SC2=C(C=C1)C)C

InChI

InChI=1S/C24H29N3O2S/c1-16-5-6-17(2)23-22(16)18(3)26-20-15-19(7-8-21(20)30-23)24(28)25-9-4-10-27-11-13-29-14-12-27/h5-8,15H,4,9-14H2,1-3H3,(H,25,28)