3-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide

Systemtic Name: 3-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide Openeye Name: 3-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide CAS Name: 3-[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide IUPAC Name: 3-[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazin-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide Traditional Name: 3-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazino]-N-[2-(4-sulfamoylphenyl)ethyl]propionamide Formula: C23H35N6O3S+ MolecularWeight: 475.6274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)CCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)CCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C23H34N6O3S/c1-17(2)23-26-18(3)16-21(27-23)29-14-12-28(13-15-29)11-9-22(30)25-10-8-19-4-6-20(7-5-19)33(24,31)32/h4-7,16-17H,8-15H2,1-3H3,(H,25,30)(H2,24,31,32)/p+1