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

Systemtic Name: N-propan-2-yl-6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]pyridine-3-sulfonamide Openeye Name: N-isopropyl-6-[4-[(4-isopropylphenyl)methyl]piperazin-4-ium-1-yl]pyridine-3-sulfonamide CAS Name: N-propan-2-yl-6-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-4-iumyl]-3-pyridinesulfonamide IUPAC Name: N-propan-2-yl-6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]pyridine-3-sulfonamide Traditional Name: N-isopropyl-6-[4-(4-isopropylbenzyl)piperazin-4-ium-1-yl]pyridine-3-sulfonamide Formula: C22H33N4O2S+ MolecularWeight: 417.58802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)NC(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)NC(C)C

InChI

InChI=1S/C22H32N4O2S/c1-17(2)20-7-5-19(6-8-20)16-25-11-13-26(14-12-25)22-10-9-21(15-23-22)29(27,28)24-18(3)4/h5-10,15,17-18,24H,11-14,16H2,1-4H3/p+1