N-[3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-N-[(4-tetradecoxyphenyl)methyl]butanamide

Systemtic Name: N-[3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-N-[(4-tetradecoxyphenyl)methyl]butanamide Openeye Name: N-[3-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]-N-[(4-tetradecoxyphenyl)methyl]butanamide CAS Name: N-[3-[(5-methyl-3-thiazol-3-iumyl)methyl]phenyl]-N-[(4-tetradecoxyphenyl)methyl]butanamide IUPAC Name: N-[3-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-N-[(4-tetradecoxyphenyl)methyl]butanamide Traditional Name: N-[3-[(5-methylthiazol-3-ium-3-yl)methyl]phenyl]-N-(4-myristyloxybenzyl)butyramide Formula: C36H53N2O2S+ MolecularWeight: 577.88322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H53N2O2S/c1-4-6-7-8-9-10-11-12-13-14-15-16-25-40-35-23-21-32(22-24-35)29-38(36(39)18-5-2)34-20-17-19-33(26-34)28-37-27-31(3)41-30-37/h17,19-24,26-27,30H,4-16,18,25,28-29H2,1-3H3/q+1