2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]ethanamide

Systemtic Name: 2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]ethanamide Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]acetamide CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-N-[4-[(2,4-dimethylphenyl)thio]phenyl]acetamide IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-[4-(2,4-dimethylphenyl)sulfanylphenyl]acetamide Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-[4-[(2,4-dimethylphenyl)thio]phenyl]acetamide Formula: C24H30N3O2S+ MolecularWeight: 424.5789

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4CC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4CC4)C

InChI

InChI=1S/C24H29N3O2S/c1-17-3-10-22(18(2)15-17)30-21-8-6-20(7-9-21)25-23(28)16-26-11-13-27(14-12-26)24(29)19-4-5-19/h3,6-10,15,19H,4-5,11-14,16H2,1-2H3,(H,25,28)/p+1