N1,N4-bis[(1-methylimidazo[1,2-a]pyridin-4-ium-2-yl)methylideneamino]benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate

Systemtic Name: N1,N4-bis[(1-methylimidazo[1,2-a]pyridin-4-ium-2-yl)methylideneamino]benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate Openeye Name: N1,N4-bis[(1-methylimidazo[1,2-a]pyridin-4-ium-2-yl)methyleneamino]terephthalamide; 4-methylbenzenesulfonate CAS Name: N1,N4-bis[(1-methyl-2-imidazo[1,2-a]pyridin-4-iumyl)methylideneamino]benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate IUPAC Name: 1-N,4-N-bis[(1-methylimidazo[1,2-a]pyridin-4-ium-2-yl)methylideneamino]benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate Traditional Name: N,N'-bis[(1-methylimidazo[1,2-a]pyridin-4-ium-2-yl)methyleneamino]terephthalamide tosylate Formula: C33H31N8O5S+ MolecularWeight: 651.71484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C2=CC=CC=[N+]2C=C1C=NNC(=O)C3=CC=C(C=C3)C(=O)NN=CC4=C[N+]5=CC=CC=C5N4C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C2=CC=CC=[N+]2C=C1C=NNC(=O)C3=CC=C(C=C3)C(=O)NN=CC4=C[N+]5=CC=CC=C5N4C

InChI

InChI=1S/C26H22N8O2.C7H8O3S/c1-31-21(17-33-13-5-3-7-23(31)33)15-27-29-25(35)19-9-11-20(12-10-19)26(36)30-28-16-22-18-34-14-6-4-8-24(34)32(22)2;1-6-2-4-7(5-3-6)11(8,9)10/h3-18H,1-2H3;2-5H,1H3,(H,8,9,10)/p+1