6-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-N-propan-2-yl-pyridine-3-sulfonamide

Systemtic Name: 6-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-N-propan-2-yl-pyridine-3-sulfonamide Openeye Name: N-isopropyl-6-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]pyridine-3-sulfonamide CAS Name: 6-[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-N-propan-2-yl-3-pyridinesulfonamide IUPAC Name: 6-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-N-propan-2-ylpyridine-3-sulfonamide Traditional Name: N-isopropyl-6-(4-p-anisylpiperazin-4-ium-1-yl)pyridine-3-sulfonamide Formula: C20H29N4O3S+ MolecularWeight: 405.53426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CN=C(C=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CN=C(C=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H28N4O3S/c1-16(2)22-28(25,26)19-8-9-20(21-14-19)24-12-10-23(11-13-24)15-17-4-6-18(27-3)7-5-17/h4-9,14,16,22H,10-13,15H2,1-3H3/p+1