[5-[cyclohexyl(pyridin-1-ium-2-yl)carbamoyl]-2-methyl-phenyl]sulfonyl-(2-methoxyphenyl)azanide

Systemtic Name: [5-[cyclohexyl(pyridin-1-ium-2-yl)carbamoyl]-2-methyl-phenyl]sulfonyl-(2-methoxyphenyl)azanide Openeye Name: [5-[cyclohexyl(pyridin-1-ium-2-yl)carbamoyl]-2-methyl-phenyl]sulfonyl-(2-methoxyphenyl)azanide CAS Name: [5-[[cyclohexyl(2-pyridin-1-iumyl)amino]-oxomethyl]-2-methylphenyl]sulfonyl-(2-methoxyphenyl)azanide IUPAC Name: [5-[cyclohexyl(pyridin-1-ium-2-yl)carbamoyl]-2-methylphenyl]sulfonyl-(2-methoxyphenyl)azanide Traditional Name: [5-[cyclohexyl(pyridin-1-ium-2-yl)carbamoyl]-2-methyl-phenyl]sulfonyl-(2-methoxyphenyl)azanide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(C2CCCCC2)C3=CC=CC=[NH+]3)S(=O)(=O)[N-]C4=CC=CC=C4OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(C2CCCCC2)C3=CC=CC=[NH+]3)S(=O)(=O)[N-]C4=CC=CC=C4OC

InChI

InChI=1S/C26H28N3O4S/c1-19-15-16-20(18-24(19)34(31,32)28-22-12-6-7-13-23(22)33-2)26(30)29(21-10-4-3-5-11-21)25-14-8-9-17-27-25/h6-9,12-18,21H,3-5,10-11H2,1-2H3/q-1/p+1