[4-[4-(5-chloranyl-1-methyl-imidazol-4-yl)sulfonylpiperazin-1-yl]phenyl] 5-chloranyl-1-methyl-imidazole-4-sulfonate

Systemtic Name: [4-[4-(5-chloranyl-1-methyl-imidazol-4-yl)sulfonylpiperazin-1-yl]phenyl] 5-chloranyl-1-methyl-imidazole-4-sulfonate Openeye Name: [4-[4-(5-chloro-1-methyl-imidazol-4-yl)sulfonylpiperazin-1-yl]phenyl] 5-chloro-1-methyl-imidazole-4-sulfonate CAS Name: 5-chloro-1-methyl-4-imidazolesulfonic acid [4-[4-[(5-chloro-1-methyl-4-imidazolyl)sulfonyl]-1-piperazinyl]phenyl] ester IUPAC Name: [4-[4-(5-chloro-1-methylimidazol-4-yl)sulfonylpiperazin-1-yl]phenyl] 5-chloro-1-methylimidazole-4-sulfonate Traditional Name: 5-chloro-1-methyl-imidazole-4-sulfonic acid [4-[4-(5-chloro-1-methyl-imidazol-4-yl)sulfonylpiperazino]phenyl] ester Formula: C18H20Cl2N6O5S2 MolecularWeight: 535.4246

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1Cl)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OS(=O)(=O)C4=C(N(C=N4)C)Cl

Isomeric SMILES

CN1C=NC(=C1Cl)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OS(=O)(=O)C4=C(N(C=N4)C)Cl

InChI

InChI=1S/C18H20Cl2N6O5S2/c1-23-11-21-17(15(23)19)32(27,28)26-9-7-25(8-10-26)13-3-5-14(6-4-13)31-33(29,30)18-16(20)24(2)12-22-18/h3-6,11-12H,7-10H2,1-2H3