2-chloranyl-5-[1-ethyl-1-methyl-2-[(4-methylsulfonylphenyl)methylamino]-5-pyridin-4-yl-imidazol-1-ium-4-yl]phenol

Systemtic Name: 2-chloranyl-5-[1-ethyl-1-methyl-2-[(4-methylsulfonylphenyl)methylamino]-5-pyridin-4-yl-imidazol-1-ium-4-yl]phenol Openeye Name: 2-chloro-5-[1-ethyl-1-methyl-2-[(4-methylsulfonylphenyl)methylamino]-5-(4-pyridyl)imidazol-1-ium-4-yl]phenol CAS Name: 2-chloro-5-[1-ethyl-1-methyl-2-[(4-methylsulfonylphenyl)methylamino]-5-pyridin-4-yl-4-imidazol-1-iumyl]phenol IUPAC Name: 2-chloro-5-[1-ethyl-1-methyl-2-[(4-methylsulfonylphenyl)methylamino]-5-pyridin-4-ylimidazol-1-ium-4-yl]phenol Traditional Name: 2-chloro-5-[1-ethyl-2-[(4-mesylbenzyl)amino]-1-methyl-5-(4-pyridyl)imidazol-1-ium-4-yl]phenol Formula: C25H26ClN4O3S+ MolecularWeight: 498.01694

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C(=C(N=C1NCC2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=C(C=C3)Cl)O)C4=CC=NC=C4)C

Isomeric SMILES

CC[N+]1(C(=C(N=C1NCC2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=C(C=C3)Cl)O)C4=CC=NC=C4)C

InChI

InChI=1S/C25H25ClN4O3S/c1-4-30(2)24(18-11-13-27-14-12-18)23(19-7-10-21(26)22(31)15-19)29-25(30)28-16-17-5-8-20(9-6-17)34(3,32)33/h5-15H,4,16H2,1-3H3,(H-,27,28,29,31)/p+1