4-[2-[(2R,5S)-5-ethyl-2-(4-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl]-N-propan-2-yl-piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[2-[(2R,5S)-5-ethyl-2-(4-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl]-N-propan-2-yl-piperazin-4-ium-1-carboxamide Openeye Name: 4-[2-[(2R,5S)-5-ethyl-4-oxo-2-(p-tolyl)thiazolidin-3-yl]ethyl]-N-isopropyl-piperazin-4-ium-1-carboxamide CAS Name: 4-[2-[(2R,5S)-5-ethyl-2-(4-methylphenyl)-4-oxo-3-thiazolidinyl]ethyl]-N-propan-2-yl-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[2-[(2R,5S)-5-ethyl-2-(4-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]ethyl]-N-propan-2-ylpiperazin-4-ium-1-carboxamide Traditional Name: 4-[2-[(2R,5S)-5-ethyl-4-keto-2-(p-tolyl)thiazolidin-3-yl]ethyl]-N-isopropyl-piperazin-4-ium-1-carboxamide Formula: C22H35N4O2S+ MolecularWeight: 419.6039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C(S1)C2=CC=C(C=C2)C)CC[NH+]3CCN(CC3)C(=O)NC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H34N4O2S/c1-5-19-20(27)26(21(29-19)18-8-6-17(4)7-9-18)15-12-24-10-13-25(14-11-24)22(28)23-16(2)3/h6-9,16,19,21H,5,10-15H2,1-4H3,(H,23,28)/p+1/t19-,21+/m0/s1