2-[2-[2-(3-methyl-2-oxidanylidene-1,3-benzothiazol-6-yl)ethylamino]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-(3-methyl-2-oxidanylidene-1,3-benzothiazol-6-yl)ethylamino]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)ethylamino]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)ethylamino]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)ethylamino]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-(2-keto-3-methyl-1,3-benzothiazol-6-yl)ethylamino]ethyl]isoindoline-1,3-quinone Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)CCNCCN3C(=O)C4=CC=CC=C4C3=O)SC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)CCNCCN3C(=O)C4=CC=CC=C4C3=O)SC1=O

InChI

InChI=1S/C20H19N3O3S/c1-22-16-7-6-13(12-17(16)27-20(22)26)8-9-21-10-11-23-18(24)14-4-2-3-5-15(14)19(23)25/h2-7,12,21H,8-11H2,1H3