(3R)-1-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[[2-(4-isopropylphenyl)thiazol-4-yl]methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[[2-(4-propan-2-ylphenyl)-4-thiazolyl]methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(2-p-cumenylthiazol-4-yl)methyl]piperidin-1-ium-3-carboxamide Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C[NH+]3CCCC(C3)C(=O)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)C[NH+]3CCC[C@H](C3)C(=O)N

InChI

InChI=1S/C19H25N3OS/c1-13(2)14-5-7-15(8-6-14)19-21-17(12-24-19)11-22-9-3-4-16(10-22)18(20)23/h5-8,12-13,16H,3-4,9-11H2,1-2H3,(H2,20,23)/p+1/t16-/m1/s1