2-(3-methylphenyl)pyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione

Systemtic Name: 2-(3-methylphenyl)pyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione Openeye Name: 2-(m-tolyl)pyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione CAS Name: 2-(3-methylphenyl)pyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione IUPAC Name: 2-(3-methylphenyl)pyrrolo[3,4-b][1,5]benzothiazepine-1,3-dione Traditional Name: 2-(m-tolyl)pyrrolo[3,4-b][1,5]benzothiazepine-1,3-quinone Formula: C18H12N2O2S MolecularWeight: 320.36508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C2=O)SC4=CC=CC=C4N=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C2=O)SC4=CC=CC=C4N=C3

InChI

InChI=1S/C18H12N2O2S/c1-11-5-4-6-12(9-11)20-17(21)13-10-19-14-7-2-3-8-15(14)23-16(13)18(20)22/h2-10H,1H3