2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]isoindoline-1,3-quinone Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1C(=O)C2=CC=CC=C2C1=O)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN(CCN1C(=O)C2=CC=CC=C2C1=O)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H17N3O2S/c1-21(12-17-20-15-8-4-5-9-16(15)25-17)10-11-22-18(23)13-6-2-3-7-14(13)19(22)24/h2-9H,10-12H2,1H3