5-(1,3-benzothiazol-2-yl)-2-(4-bromophenyl)isoindole-1,3-dione

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-2-(4-bromophenyl)isoindole-1,3-dione Openeye Name: 5-(1,3-benzothiazol-2-yl)-2-(4-bromophenyl)isoindoline-1,3-dione CAS Name: 5-(1,3-benzothiazol-2-yl)-2-(4-bromophenyl)isoindole-1,3-dione IUPAC Name: 5-(1,3-benzothiazol-2-yl)-2-(4-bromophenyl)isoindole-1,3-dione Traditional Name: 5-(1,3-benzothiazol-2-yl)-2-(4-bromophenyl)isoindoline-1,3-quinone Formula: C21H11BrN2O2S MolecularWeight: 435.29324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C21H11BrN2O2S/c22-13-6-8-14(9-7-13)24-20(25)15-10-5-12(11-16(15)21(24)26)19-23-17-3-1-2-4-18(17)27-19/h1-11H