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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2OS/c1-11(2)17-9-10-18-15(19)13(4)20-16(18)14-7-5-12(3)6-8-14/h5-8,11,13,16-17H,9-10H2,1-4H3/p+1/t13-,16+/m1/s1