2-[(4-bromophenyl)amino]-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-sulfanylidene-ethanamide

Systemtic Name: 2-[(4-bromophenyl)amino]-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-sulfanylidene-ethanamide Openeye Name: 2-(4-bromoanilino)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-thioxo-acetamide CAS Name: 2-(4-bromoanilino)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-2-sulfanylideneacetamide IUPAC Name: 2-(4-bromoanilino)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-2-sulfanylideneacetamide Traditional Name: 2-(4-bromoanilino)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-thioxo-acetamide Formula: C22H18BrN3O5S MolecularWeight: 516.36442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H18BrN3O5S/c1-2-30-18-7-9-19(10-8-18)31-20-12-16(11-17(13-20)26(28)29)24-21(27)22(32)25-15-5-3-14(23)4-6-15/h3-13H,2H2,1H3,(H,24,27)(H,25,32)