methyl N-[6-[4-[(2-bromanyl-3-nitro-phenyl)carbonylamino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate

Systemtic Name: methyl N-[6-[4-[(2-bromanyl-3-nitro-phenyl)carbonylamino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate Openeye Name: methyl N-[6-[4-[(2-bromo-3-nitro-benzoyl)amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[[4-[[(2-bromo-3-nitrophenyl)-oxomethyl]amino]phenyl]thio]-1H-benzimidazol-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[6-[4-[(2-bromo-3-nitrobenzoyl)amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[[4-[(2-bromo-3-nitro-benzoyl)amino]phenyl]thio]-1H-benzimidazol-2-yl]carbamic acid methyl ester Formula: C22H16BrN5O5S MolecularWeight: 542.36194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=C(C=C3)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])Br

Isomeric SMILES

COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=C(C=C3)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C22H16BrN5O5S/c1-33-22(30)27-21-25-16-10-9-14(11-17(16)26-21)34-13-7-5-12(6-8-13)24-20(29)15-3-2-4-18(19(15)23)28(31)32/h2-11H,1H3,(H,24,29)(H2,25,26,27,30)