5-(4-morpholin-4-yl-4-oxidanylidene-butyl)pyrido[2,3-b][1,4]benzothiazepin-6-one

Systemtic Name: 5-(4-morpholin-4-yl-4-oxidanylidene-butyl)pyrido[2,3-b][1,4]benzothiazepin-6-one Openeye Name: 5-(4-morpholino-4-oxo-butyl)pyrido[2,3-b][1,4]benzothiazepin-6-one CAS Name: 5-[4-(4-morpholinyl)-4-oxobutyl]-6-pyrido[2,3-b][1,4]benzothiazepinone IUPAC Name: 5-(4-morpholin-4-yl-4-oxobutyl)pyrido[2,3-b][1,4]benzothiazepin-6-one Traditional Name: 5-(4-keto-4-morpholino-butyl)pyrido[2,3-b][1,4]benzothiazepin-6-one Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CCCN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

Isomeric SMILES

C1COCCN1C(=O)CCCN2C3=C(N=CC=C3)SC4=CC=CC=C4C2=O

InChI

InChI=1S/C20H21N3O3S/c24-18(22-11-13-26-14-12-22)8-4-10-23-16-6-3-9-21-19(16)27-17-7-2-1-5-15(17)20(23)25/h1-3,5-7,9H,4,8,10-14H2