N-[4-[bis(azanyl)methylideneamino]sulfonylphenyl]-2-(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)ethanamide perchlorate

Systemtic Name: N-[4-[bis(azanyl)methylideneamino]sulfonylphenyl]-2-(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)ethanamide perchlorate Openeye Name: 2-(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)-N-(4-guanidinosulfonylphenyl)acetamide perchlorate CAS Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-2-(2-ethyl-4,6-diphenyl-1-pyridin-1-iumyl)acetamide perchlorate IUPAC Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-2-(2-ethyl-4,6-diphenylpyridin-1-ium-1-yl)acetamide perchlorate Traditional Name: 2-(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)-N-(4-guanidinosulfonylphenyl)acetamide perchlorate Formula: C28H28ClN5O7S MolecularWeight: 614.06922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC1=CC(=CC(=[N+]1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H27N5O3S.ClHO4/c1-2-24-17-22(20-9-5-3-6-10-20)18-26(21-11-7-4-8-12-21)33(24)19-27(34)31-23-13-15-25(16-14-23)37(35,36)32-28(29)30;2-1(3,4)5/h3-18H,2,19H2,1H3,(H4-,29,30,31,32,34);(H,2,3,4,5)