2-(1,3-benzothiazol-2-ylmethyl)isoindole-1,3-dione

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethyl)isoindole-1,3-dione Openeye Name: 2-(1,3-benzothiazol-2-ylmethyl)isoindoline-1,3-dione CAS Name: 2-(1,3-benzothiazol-2-ylmethyl)isoindole-1,3-dione IUPAC Name: 2-(1,3-benzothiazol-2-ylmethyl)isoindole-1,3-dione Traditional Name: 2-(1,3-benzothiazol-2-ylmethyl)isoindoline-1,3-quinone Formula: C16H10N2O2S MolecularWeight: 294.3278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C16H10N2O2S/c19-15-10-5-1-2-6-11(10)16(20)18(15)9-14-17-12-7-3-4-8-13(12)21-14/h1-8H,9H2