(4S)-3-ethyl-4-(4-methylphenyl)-2-(pyridin-2-ylmethylamino)-5H-1,3-thiazol-3-ium-4-ol

Systemtic Name: (4S)-3-ethyl-4-(4-methylphenyl)-2-(pyridin-2-ylmethylamino)-5H-1,3-thiazol-3-ium-4-ol Openeye Name: (4S)-3-ethyl-4-(p-tolyl)-2-(2-pyridylmethylamino)-5H-thiazol-3-ium-4-ol CAS Name: (4S)-3-ethyl-4-(4-methylphenyl)-2-(2-pyridinylmethylamino)-5H-thiazol-3-ium-4-ol IUPAC Name: (4S)-3-ethyl-4-(4-methylphenyl)-2-(pyridin-2-ylmethylamino)-5H-1,3-thiazol-3-ium-4-ol Traditional Name: (4S)-3-ethyl-4-(p-tolyl)-2-(2-pyridylmethylamino)-2-thiazolin-3-ium-4-ol Formula: C18H22N3OS+ MolecularWeight: 328.45178

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SCC1(C2=CC=C(C=C2)C)O)NCC3=CC=CC=N3

Isomeric SMILES

CC[N+]1=C(SC[C@]1(C2=CC=C(C=C2)C)O)NCC3=CC=CC=N3

InChI

InChI=1S/C18H21N3OS/c1-3-21-17(20-12-16-6-4-5-11-19-16)23-13-18(21,22)15-9-7-14(2)8-10-15/h4-11,22H,3,12-13H2,1-2H3/p+1/t18-/m1/s1