2-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)-1-phenyl-benzimidazol-5-amine

Systemtic Name: 2-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)-1-phenyl-benzimidazol-5-amine Openeye Name: 2-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)-1-phenyl-benzimidazol-5-amine CAS Name: 2-methyl-N-(4-methylsulfonyl-2-nitrophenyl)-1-phenyl-5-benzimidazolamine IUPAC Name: 2-methyl-N-(4-methylsulfonyl-2-nitrophenyl)-1-phenylbenzimidazol-5-amine Traditional Name: (4-mesyl-2-nitro-phenyl)-(2-methyl-1-phenyl-benzimidazol-5-yl)amine Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)NC4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)NC4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O4S/c1-14-22-19-12-15(8-11-20(19)24(14)16-6-4-3-5-7-16)23-18-10-9-17(30(2,28)29)13-21(18)25(26)27/h3-13,23H,1-2H3