3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-butyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-butyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(1,3-dioxoisoindolin-2-yl)benzamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(1,3-dioxo-2-isoindolyl)benzamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(1,3-dioxoisoindol-2-yl)benzamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-phthalimido-benzamide Formula: C26H21N3O3S MolecularWeight: 455.52824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H21N3O3S/c1-2-3-7-16-12-13-21-22(14-16)33-26(27-21)28-23(30)17-8-6-9-18(15-17)29-24(31)19-10-4-5-11-20(19)25(29)32/h4-6,8-15H,2-3,7H2,1H3,(H,27,28,30)