N4-[(1-methylimidazol-2-yl)-phenyl-methyl]benzene-1,4-disulfonamide

Systemtic Name: N4-[(1-methylimidazol-2-yl)-phenyl-methyl]benzene-1,4-disulfonamide Openeye Name: N4-[(1-methylimidazol-2-yl)-phenyl-methyl]benzene-1,4-disulfonamide CAS Name: N4-[(1-methyl-2-imidazolyl)-phenylmethyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-[(1-methylimidazol-2-yl)-phenylmethyl]benzene-1,4-disulfonamide Traditional Name: N'-[(1-methylimidazol-2-yl)-phenyl-methyl]benzene-1,4-disulfonamide Formula: C17H18N4O4S2 MolecularWeight: 406.47922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C17H18N4O4S2/c1-21-12-11-19-17(21)16(13-5-3-2-4-6-13)20-27(24,25)15-9-7-14(8-10-15)26(18,22)23/h2-12,16,20H,1H3,(H2,18,22,23)