2-[(4-bromophenyl)-(4-chloranyl-3-nitro-phenyl)sulfonyl-amino]-N-(2-cyanophenyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)-(4-chloranyl-3-nitro-phenyl)sulfonyl-amino]-N-(2-cyanophenyl)ethanamide Openeye Name: 2-(4-bromo-N-(4-chloro-3-nitro-phenyl)sulfonyl-anilino)-N-(2-cyanophenyl)acetamide CAS Name: 2-(4-bromo-N-(4-chloro-3-nitrophenyl)sulfonylanilino)-N-(2-cyanophenyl)acetamide IUPAC Name: 2-(4-bromo-N-(4-chloro-3-nitrophenyl)sulfonylanilino)-N-(2-cyanophenyl)acetamide Traditional Name: 2-(4-bromo-N-(4-chloro-3-nitro-phenyl)sulfonyl-anilino)-N-(2-cyanophenyl)acetamide Formula: C21H14BrClN4O5S MolecularWeight: 549.78166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=O)CN(C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=O)CN(C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H14BrClN4O5S/c22-15-5-7-16(8-6-15)26(13-21(28)25-19-4-2-1-3-14(19)12-24)33(31,32)17-9-10-18(23)20(11-17)27(29)30/h1-11H,13H2,(H,25,28)