N-[[3-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbamothioyl]-4-butoxy-benzamide

Systemtic Name: N-[[3-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbamothioyl]-4-butoxy-benzamide Openeye Name: 4-butoxy-N-[[3-(1,3-dioxoisoindolin-2-yl)phenyl]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[3-(1,3-dioxo-2-isoindolyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[3-(1,3-dioxoisoindol-2-yl)phenyl]carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(3-phthalimidophenyl)thiocarbamoyl]benzamide Formula: C26H23N3O4S MolecularWeight: 473.54352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H23N3O4S/c1-2-3-15-33-20-13-11-17(12-14-20)23(30)28-26(34)27-18-7-6-8-19(16-18)29-24(31)21-9-4-5-10-22(21)25(29)32/h4-14,16H,2-3,15H2,1H3,(H2,27,28,30,34)