2-(3-fluoranyl-2-tetradecoxy-phenyl)-N-[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide

Systemtic Name: 2-(3-fluoranyl-2-tetradecoxy-phenyl)-N-[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]ethanamide Openeye Name: 2-(3-fluoro-2-tetradecoxy-phenyl)-N-[2-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide CAS Name: 2-(3-fluoro-2-tetradecoxyphenyl)-N-[2-[(5-methyl-3-thiazol-3-iumyl)methyl]phenyl]acetamide IUPAC Name: 2-(3-fluoro-2-tetradecoxyphenyl)-N-[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]acetamide Traditional Name: 2-(3-fluoro-2-myristyloxy-phenyl)-N-[2-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]acetamide Formula: C33H46FN2O2S+ MolecularWeight: 553.793943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC=C1F)CC(=O)NC2=CC=CC=C2C[N+]3=CSC(=C3)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1F)CC(=O)NC2=CC=CC=C2C[N+]3=CSC(=C3)C

InChI

InChI=1S/C33H45FN2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-16-22-38-33-28(19-17-20-30(33)34)23-32(37)35-31-21-15-14-18-29(31)25-36-24-27(2)39-26-36/h14-15,17-21,24,26H,3-13,16,22-23,25H2,1-2H3/p+1