dimethyl-(2-oxidanyl-2-pyridin-3-yl-ethyl)-[2-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]ethyl]azanium

Systemtic Name: dimethyl-(2-oxidanyl-2-pyridin-3-yl-ethyl)-[2-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]ethyl]azanium Openeye Name: [2-hydroxy-2-(3-pyridyl)ethyl]-dimethyl-[2-[4-(2-phenylthiazol-4-yl)phenyl]ethyl]ammonium CAS Name: [2-hydroxy-2-(3-pyridinyl)ethyl]-dimethyl-[2-[4-(2-phenyl-4-thiazolyl)phenyl]ethyl]ammonium IUPAC Name: (2-hydroxy-2-pyridin-3-ylethyl)-dimethyl-[2-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]ethyl]azanium Traditional Name: [2-hydroxy-2-(3-pyridyl)ethyl]-dimethyl-[2-[4-(2-phenylthiazol-4-yl)phenyl]ethyl]ammonium Formula: C26H28N3OS+ MolecularWeight: 430.58502

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=CC=C3)CC(C4=CN=CC=C4)O

Isomeric SMILES

C[N+](C)(CCC1=CC=C(C=C1)C2=CSC(=N2)C3=CC=CC=C3)CC(C4=CN=CC=C4)O

InChI

InChI=1S/C26H28N3OS/c1-29(2,18-25(30)23-9-6-15-27-17-23)16-14-20-10-12-21(13-11-20)24-19-31-26(28-24)22-7-4-3-5-8-22/h3-13,15,17,19,25,30H,14,16,18H2,1-2H3/q+1