2-(2-methoxyphenyl)-4-phenyl-4,5-dihydropyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione

Systemtic Name: 2-(2-methoxyphenyl)-4-phenyl-4,5-dihydropyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione Openeye Name: 2-(2-methoxyphenyl)-4-phenyl-4,5-dihydropyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione CAS Name: 2-(2-methoxyphenyl)-4-phenyl-4,5-dihydropyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione IUPAC Name: 2-(2-methoxyphenyl)-4-phenyl-4,5-dihydropyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione Traditional Name: 2-(2-methoxyphenyl)-4-phenyl-4,5-dihydropyrrolo[3,4-b][1,5]benzothiazepine-1,3-quinone Formula: C24H18N2O3S MolecularWeight: 414.47632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C3=C(C2=O)SC4=CC=CC=C4NC3C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)C3=C(C2=O)SC4=CC=CC=C4NC3C5=CC=CC=C5

InChI

InChI=1S/C24H18N2O3S/c1-29-18-13-7-6-12-17(18)26-23(27)20-21(15-9-3-2-4-10-15)25-16-11-5-8-14-19(16)30-22(20)24(26)28/h2-14,21,25H,1H3