N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-(p-tolylsulfonyl)propanamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-tosyl-propionamide Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C23H31N3O3S/c1-4-25-12-14-26(15-13-25)22-10-7-20(17-19(22)3)24-23(27)11-16-30(28,29)21-8-5-18(2)6-9-21/h5-10,17H,4,11-16H2,1-3H3,(H,24,27)/p+1