3-[(2R,5S)-5-ethyl-2-(4-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propyl-methyl-azanium

Systemtic Name: 3-[(2R,5S)-5-ethyl-2-(4-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propyl-methyl-azanium Openeye Name: 3-[(2R,5S)-5-ethyl-4-oxo-2-(p-tolyl)thiazolidin-3-yl]propyl-methyl-ammonium CAS Name: 3-[(2R,5S)-5-ethyl-2-(4-methylphenyl)-4-oxo-3-thiazolidinyl]propyl-methylammonium IUPAC Name: 3-[(2R,5S)-5-ethyl-2-(4-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propyl-methylazanium Traditional Name: 3-[(2R,5S)-5-ethyl-4-keto-2-(p-tolyl)thiazolidin-3-yl]propyl-methyl-ammonium Formula: C16H25N2OS+ MolecularWeight: 293.4475

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C(S1)C2=CC=C(C=C2)C)CCC[NH2+]C

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2OS/c1-4-14-15(19)18(11-5-10-17-3)16(20-14)13-8-6-12(2)7-9-13/h6-9,14,16-17H,4-5,10-11H2,1-3H3/p+1/t14-,16+/m0/s1