(2R,5S)-2-(4-tert-butylphenyl)-5-methyl-3-(2-piperazine-1,4-diium-1-ylethyl)-1,3-thiazolidin-4-one

Systemtic Name: (2R,5S)-2-(4-tert-butylphenyl)-5-methyl-3-(2-piperazine-1,4-diium-1-ylethyl)-1,3-thiazolidin-4-one Openeye Name: (2R,5S)-2-(4-tert-butylphenyl)-5-methyl-3-(2-piperazine-1,4-diium-1-ylethyl)thiazolidin-4-one CAS Name: (2R,5S)-2-(4-tert-butylphenyl)-5-methyl-3-[2-(1-piperazine-1,4-diiumyl)ethyl]-4-thiazolidinone IUPAC Name: (2R,5S)-2-(4-tert-butylphenyl)-5-methyl-3-(2-piperazine-1,4-diium-1-ylethyl)-1,3-thiazolidin-4-one Traditional Name: (2R,5S)-2-(4-tert-butylphenyl)-5-methyl-3-(2-piperazine-1,4-diium-1-ylethyl)thiazolidin-4-one Formula: C20H33N3OS+2 MolecularWeight: 363.56052

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(S1)C2=CC=C(C=C2)C(C)(C)C)CC[NH+]3CC[NH2+]CC3

Isomeric SMILES

C[C@H]1C(=O)N([C@H](S1)C2=CC=C(C=C2)C(C)(C)C)CC[NH+]3CC[NH2+]CC3

InChI

InChI=1S/C20H31N3OS/c1-15-18(24)23(14-13-22-11-9-21-10-12-22)19(25-15)16-5-7-17(8-6-16)20(2,3)4/h5-8,15,19,21H,9-14H2,1-4H3/p+2/t15-,19+/m0/s1