3-bromanyl-4-ethoxy-N-[[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[(2-methyl-1,3-dioxo-isoindolin-5-yl)carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[(2-methyl-1,3-dioxo-5-isoindolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[(2-methyl-1,3-dioxoisoindol-5-yl)carbamothioyl]benzamide Traditional Name: 3-bromo-N-[(1,3-diketo-2-methyl-isoindolin-5-yl)thiocarbamoyl]-4-ethoxy-benzamide Formula: C19H16BrN3O4S MolecularWeight: 462.31704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)C(=O)N(C3=O)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)C(=O)N(C3=O)C)Br

InChI

InChI=1S/C19H16BrN3O4S/c1-3-27-15-7-4-10(8-14(15)20)16(24)22-19(28)21-11-5-6-12-13(9-11)18(26)23(2)17(12)25/h4-9H,3H2,1-2H3,(H2,21,22,24,28)