4-methyl-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-[[4-(2-methyl-1-imidazolyl)phenyl]methyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-[4-(2-methylimidazol-1-yl)benzyl]-3-nitro-benzenesulfonamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)N3C=CN=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)N3C=CN=C3C)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c1-13-3-8-17(11-18(13)22(23)24)27(25,26)20-12-15-4-6-16(7-5-15)21-10-9-19-14(21)2/h3-11,20H,12H2,1-2H3