N-[(2-bromanyl-4-nitro-phenyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide

Systemtic Name: N-[(2-bromanyl-4-nitro-phenyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide Openeye Name: N-[(2-bromo-4-nitro-phenyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide CAS Name: N-[(2-bromo-4-nitroanilino)-sulfanylidenemethyl]-2-(2-methoxyethoxy)benzamide IUPAC Name: N-[(2-bromo-4-nitrophenyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide Traditional Name: N-[(2-bromo-4-nitro-phenyl)thiocarbamoyl]-2-(2-methoxyethoxy)benzamide Formula: C17H16BrN3O5S MolecularWeight: 454.29504

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

COCCOC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C17H16BrN3O5S/c1-25-8-9-26-15-5-3-2-4-12(15)16(22)20-17(27)19-14-7-6-11(21(23)24)10-13(14)18/h2-7,10H,8-9H2,1H3,(H2,19,20,22,27)