5-(1,3-benzothiazol-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione Openeye Name: 5-(1,3-benzothiazol-2-yl)-2-(o-tolyl)isoindoline-1,3-dione CAS Name: 5-(1,3-benzothiazol-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione IUPAC Name: 5-(1,3-benzothiazol-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione Traditional Name: 5-(1,3-benzothiazol-2-yl)-2-(o-tolyl)isoindoline-1,3-quinone Formula: C22H14N2O2S MolecularWeight: 370.42376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H14N2O2S/c1-13-6-2-4-8-18(13)24-21(25)15-11-10-14(12-16(15)22(24)26)20-23-17-7-3-5-9-19(17)27-20/h2-12H,1H3