3-(2,3-dihydroindol-1-ylcarbonyl)-5-ethyl-11-oxidanylidene-benzo[b][1,4]benzothiazepin-6-one

Systemtic Name: 3-(2,3-dihydroindol-1-ylcarbonyl)-5-ethyl-11-oxidanylidene-benzo[b][1,4]benzothiazepin-6-one Openeye Name: 5-ethyl-3-(indoline-1-carbonyl)-11-oxo-benzo[b][1,4]benzothiazepin-6-one CAS Name: 3-[2,3-dihydroindol-1-yl(oxo)methyl]-5-ethyl-11-oxo-6-benzo[b][1,4]benzothiazepinone IUPAC Name: 3-(2,3-dihydroindole-1-carbonyl)-5-ethyl-11-oxobenzo[b][1,4]benzothiazepin-6-one Traditional Name: 5-ethyl-3-(indoline-1-carbonyl)-11-keto-benzo[b][1,4]benzothiazepin-6-one Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C(=O)N3CCC4=CC=CC=C43)S(=O)C5=CC=CC=C5C1=O

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C(=O)N3CCC4=CC=CC=C43)S(=O)C5=CC=CC=C5C1=O

InChI

InChI=1S/C24H20N2O3S/c1-2-25-20-15-17(23(27)26-14-13-16-7-3-5-9-19(16)26)11-12-22(20)30(29)21-10-6-4-8-18(21)24(25)28/h3-12,15H,2,13-14H2,1H3