2-(2-bromanyl-4-ethyl-phenoxy)-N-[(4-nitrophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-[(4-nitrophenyl)carbamothioyl]ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[(4-nitrophenyl)carbamothioyl]acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-[(4-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-[(4-nitrophenyl)carbamothioyl]acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[(4-nitrophenyl)thiocarbamoyl]acetamide Formula: C17H16BrN3O4S MolecularWeight: 438.29564

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C17H16BrN3O4S/c1-2-11-3-8-15(14(18)9-11)25-10-16(22)20-17(26)19-12-4-6-13(7-5-12)21(23)24/h3-9H,2,10H2,1H3,(H2,19,20,22,26)