2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]-N-(3-tetradecoxyphenyl)benzamide

Systemtic Name: 2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]-N-(3-tetradecoxyphenyl)benzamide Openeye Name: 2-[(5-methylthiazol-3-ium-3-yl)methyl]-N-(3-tetradecoxyphenyl)benzamide CAS Name: 2-[(5-methyl-3-thiazol-3-iumyl)methyl]-N-(3-tetradecoxyphenyl)benzamide IUPAC Name: 2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]-N-(3-tetradecoxyphenyl)benzamide Traditional Name: 2-[(5-methylthiazol-3-ium-3-yl)methyl]-N-(3-myristyloxyphenyl)benzamide Formula: C32H45N2O2S+ MolecularWeight: 521.7769

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C[N+]3=CSC(=C3)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C[N+]3=CSC(=C3)C

InChI

InChI=1S/C32H44N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-16-22-36-30-20-17-19-29(23-30)33-32(35)31-21-15-14-18-28(31)25-34-24-27(2)37-26-34/h14-15,17-21,23-24,26H,3-13,16,22,25H2,1-2H3/p+1