2-[1-[2-(2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethylamino]propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-[2-(2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethylamino]propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-methyl-2-[2-(2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]isoindoline-1,3-dione CAS Name: 2-[1-[2-(2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]propan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-[2-(2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]propan-2-yl]isoindole-1,3-dione Traditional Name: 2-[2-[2-(2-keto-3H-1,3-benzothiazol-7-yl)ethylamino]-1-methyl-ethyl]isoindoline-1,3-quinone Formula: C20H19N3O3S MolecularWeight: 381.44816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNCCC1=C2C(=CC=C1)NC(=O)S2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(CNCCC1=C2C(=CC=C1)NC(=O)S2)N3C(=O)C4=CC=CC=C4C3=O

InChI

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