(2S)-3-[2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethyl]-2-(3-methylphenyl)-1,3-thiazolidin-4-one

Systemtic Name: (2S)-3-[2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethyl]-2-(3-methylphenyl)-1,3-thiazolidin-4-one Openeye Name: (2S)-3-[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]ethyl]-2-(m-tolyl)thiazolidin-4-one CAS Name: (2S)-3-[2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]ethyl]-2-(3-methylphenyl)-4-thiazolidinone IUPAC Name: (2S)-3-[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]ethyl]-2-(3-methylphenyl)-1,3-thiazolidin-4-one Traditional Name: (2S)-3-[2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]ethyl]-2-(m-tolyl)thiazolidin-4-one Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2N(C(=O)CS2)CC[NH+]3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC=CC(=C1)[C@H]2N(C(=O)CS2)CC[NH+]3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C20H27N3O2S/c1-15-3-2-4-17(13-15)20-23(18(24)14-26-20)12-9-21-7-10-22(11-8-21)19(25)16-5-6-16/h2-4,13,16,20H,5-12,14H2,1H3/p+1/t20-/m0/s1