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

Systemtic Name: 2-[(2R,5S)-2-(4-tert-butylphenyl)-5-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl-methyl-azanium Openeye Name: 2-[(2R,5S)-2-(4-tert-butylphenyl)-5-methyl-4-oxo-thiazolidin-3-yl]ethyl-methyl-ammonium CAS Name: 2-[(2R,5S)-2-(4-tert-butylphenyl)-5-methyl-4-oxo-3-thiazolidinyl]ethyl-methylammonium IUPAC Name: 2-[(2R,5S)-2-(4-tert-butylphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]ethyl-methylazanium Traditional Name: 2-[(2R,5S)-2-(4-tert-butylphenyl)-4-keto-5-methyl-thiazolidin-3-yl]ethyl-methyl-ammonium Formula: C17H27N2OS+ MolecularWeight: 307.47408

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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[NH2+]C

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2OS/c1-12-15(20)19(11-10-18-5)16(21-12)13-6-8-14(9-7-13)17(2,3)4/h6-9,12,16,18H,10-11H2,1-5H3/p+1/t12-,16+/m0/s1