2-[3-[2-(2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl-propyl-amino]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[2-(2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl-propyl-amino]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[2-(2-oxo-3H-1,3-benzothiazol-7-yl)ethyl-propyl-amino]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[2-(2-oxo-3H-1,3-benzothiazol-7-yl)ethyl-propylamino]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[2-(2-oxo-3H-1,3-benzothiazol-7-yl)ethyl-propylamino]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[2-(2-keto-3H-1,3-benzothiazol-7-yl)ethyl-propyl-amino]propyl]isoindoline-1,3-quinone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCN1C(=O)C2=CC=CC=C2C1=O)CCC3=C4C(=CC=C3)NC(=O)S4

Isomeric SMILES

CCCN(CCCN1C(=O)C2=CC=CC=C2C1=O)CCC3=C4C(=CC=C3)NC(=O)S4

InChI

InChI=1S/C23H25N3O3S/c1-2-12-25(15-11-16-7-5-10-19-20(16)30-23(29)24-19)13-6-14-26-21(27)17-8-3-4-9-18(17)22(26)28/h3-5,7-10H,2,6,11-15H2,1H3,(H,24,29)