N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridinamine IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-amine Traditional Name: methyl-[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]-o-veratryl-amine Formula: C20H29N4O4S+ MolecularWeight: 421.53366

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N(C)CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)N(C)CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C20H28N4O4S/c1-22-10-12-24(13-11-22)29(25,26)17-8-9-19(21-14-17)23(2)15-16-6-5-7-18(27-3)20(16)28-4/h5-9,14H,10-13,15H2,1-4H3/p+1