1-(2,5-dimethoxyphenyl)-3-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)urea

Systemtic Name: 1-(2,5-dimethoxyphenyl)-3-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)urea Openeye Name: 1-(2,5-dimethoxyphenyl)-3-(5-ethyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)urea CAS Name: 1-(2,5-dimethoxyphenyl)-3-(5-ethyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)urea IUPAC Name: 1-(2,5-dimethoxyphenyl)-3-(5-ethyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)urea Traditional Name: 1-(2,5-dimethoxyphenyl)-3-(5-ethyl-6-keto-benzo[b][1,4]benzothiazepin-3-yl)urea Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)NC(=O)NC3=C(C=CC(=C3)OC)OC)SC4=CC=CC=C4C1=O

Isomeric SMILES

CCN1C2=C(C=CC(=C2)NC(=O)NC3=C(C=CC(=C3)OC)OC)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C24H23N3O4S/c1-4-27-19-13-15(9-12-22(19)32-21-8-6-5-7-17(21)23(27)28)25-24(29)26-18-14-16(30-2)10-11-20(18)31-3/h5-14H,4H2,1-3H3,(H2,25,26,29)