(2S,5R)-5-methyl-2-(4-methylphenyl)-3-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazolidin-4-one

Systemtic Name: (2S,5R)-5-methyl-2-(4-methylphenyl)-3-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazolidin-4-one Openeye Name: (2S,5R)-5-methyl-2-(p-tolyl)-3-(2-pyrrolidin-1-ium-1-ylethyl)thiazolidin-4-one CAS Name: (2S,5R)-5-methyl-2-(4-methylphenyl)-3-[2-(1-pyrrolidin-1-iumyl)ethyl]-4-thiazolidinone IUPAC Name: (2S,5R)-5-methyl-2-(4-methylphenyl)-3-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazolidin-4-one Traditional Name: (2S,5R)-5-methyl-2-(p-tolyl)-3-(2-pyrrolidin-1-ium-1-ylethyl)thiazolidin-4-one Formula: C17H25N2OS+ MolecularWeight: 305.4582

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(S1)C2=CC=C(C=C2)C)CC[NH+]3CCCC3

Isomeric SMILES

C[C@@H]1C(=O)N([C@@H](S1)C2=CC=C(C=C2)C)CC[NH+]3CCCC3

InChI

InChI=1S/C17H24N2OS/c1-13-5-7-15(8-6-13)17-19(16(20)14(2)21-17)12-11-18-9-3-4-10-18/h5-8,14,17H,3-4,9-12H2,1-2H3/p+1/t14-,17+/m1/s1