2-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]isoindole-1,3-dione Openeye Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]isoindoline-1,3-dione CAS Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]isoindole-1,3-dione Traditional Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]isoindoline-1,3-quinone Formula: C22H14N2O2S MolecularWeight: 370.42376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

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