5-methyl-N-(2-morpholin-4-ylethyl)-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 5-methyl-N-(2-morpholin-4-ylethyl)-6-oxidanylidene-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 5-methyl-N-(2-morpholinoethyl)-6-oxo-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 5-methyl-N-[2-(4-morpholinyl)ethyl]-6-oxo-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 5-methyl-N-(2-morpholin-4-ylethyl)-6-oxobenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 6-keto-5-methyl-N-(2-morpholinoethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NCCN3CCOCC3)SC4=CC=CC=C4C1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NCCN3CCOCC3)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C21H23N3O3S/c1-23-17-14-15(20(25)22-8-9-24-10-12-27-13-11-24)6-7-19(17)28-18-5-3-2-4-16(18)21(23)26/h2-7,14H,8-13H2,1H3,(H,22,25)