(6-ethyl-8-methyl-benzo[b][1,4]benzothiazepin-3-yl)-morpholin-4-yl-methanone

Systemtic Name: (6-ethyl-8-methyl-benzo[b][1,4]benzothiazepin-3-yl)-morpholin-4-yl-methanone Openeye Name: (6-ethyl-8-methyl-benzo[b][1,4]benzothiazepin-3-yl)-morpholino-methanone CAS Name: (6-ethyl-8-methyl-3-benzo[b][1,4]benzothiazepinyl)-(4-morpholinyl)methanone IUPAC Name: (6-ethyl-8-methylbenzo[b][1,4]benzothiazepin-3-yl)-morpholin-4-ylmethanone Traditional Name: (6-ethyl-8-methyl-benzo[b][1,4]benzothiazepin-3-yl)-morpholino-methanone Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)C(=O)N3CCOCC3)SC4=C1C=C(C=C4)C

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)C(=O)N3CCOCC3)SC4=C1C=C(C=C4)C

InChI

InChI=1S/C21H22N2O2S/c1-3-17-16-12-14(2)4-6-19(16)26-20-7-5-15(13-18(20)22-17)21(24)23-8-10-25-11-9-23/h4-7,12-13H,3,8-11H2,1-2H3