N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)pyrrolidine-1-carboxamide

Systemtic Name: N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)pyrrolidine-1-carboxamide Openeye Name: N-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)pyrrolidine-1-carboxamide CAS Name: N-(5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)-1-pyrrolidinecarboxamide IUPAC Name: N-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)pyrrolidine-1-carboxamide Traditional Name: N-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-3-yl)pyrrolidine-1-carboxamide Formula: C19H19N3O2S MolecularWeight: 353.43806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)NC(=O)N3CCCC3)SC4=CC=CC=C4C1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)NC(=O)N3CCCC3)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C19H19N3O2S/c1-21-15-12-13(20-19(24)22-10-4-5-11-22)8-9-17(15)25-16-7-3-2-6-14(16)18(21)23/h2-3,6-9,12H,4-5,10-11H2,1H3,(H,20,24)