N-[4-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-2-(2-tetradecoxyphenoxy)ethanamide bromide

Systemtic Name: N-[4-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-2-(2-tetradecoxyphenoxy)ethanamide bromide Openeye Name: N-[4-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]-2-(2-tetradecoxyphenoxy)acetamide bromide CAS Name: N-[4-[(5-methyl-3-thiazol-3-iumyl)methyl]phenyl]-2-(2-tetradecoxyphenoxy)acetamide bromide IUPAC Name: N-[4-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-2-(2-tetradecoxyphenoxy)acetamide bromide Traditional Name: N-[4-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]-2-(2-myristyloxyphenoxy)acetamide bromide Formula: C33H47BrN2O3S MolecularWeight: 631.70688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC=C1OCC(=O)NC2=CC=C(C=C2)C[N+]3=CSC(=C3)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC=C1OCC(=O)NC2=CC=C(C=C2)C[N+]3=CSC(=C3)C.[Br-]

InChI

InChI=1S/C33H46N2O3S.BrH/c1-3-4-5-6-7-8-9-10-11-12-13-16-23-37-31-17-14-15-18-32(31)38-26-33(36)34-30-21-19-29(20-22-30)25-35-24-28(2)39-27-35;/h14-15,17-22,24,27H,3-13,16,23,25-26H2,1-2H3;1H