5-bromanyl-2-chloranyl-N-[[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-chloro-N-[(2-methyl-1,3-dioxo-isoindolin-5-yl)carbamothioyl]benzamide CAS Name: 5-bromo-2-chloro-N-[[(2-methyl-1,3-dioxo-5-isoindolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[(2-methyl-1,3-dioxoisoindol-5-yl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-chloro-N-[(1,3-diketo-2-methyl-isoindolin-5-yl)thiocarbamoyl]benzamide Formula: C17H11BrClN3O3S MolecularWeight: 452.70954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)Cl

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)Cl

InChI

InChI=1S/C17H11BrClN3O3S/c1-22-15(24)10-4-3-9(7-11(10)16(22)25)20-17(26)21-14(23)12-6-8(18)2-5-13(12)19/h2-7H,1H3,(H2,20,21,23,26)