N-[4-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-2-tetradecoxy-benzamide

Systemtic Name: N-[4-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-2-tetradecoxy-benzamide Openeye Name: N-[4-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]-2-tetradecoxy-benzamide CAS Name: N-[4-[(4-methyl-3-thiazol-3-iumyl)methyl]phenyl]-2-tetradecoxybenzamide IUPAC Name: N-[4-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]-2-tetradecoxybenzamide Traditional Name: N-[4-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]-2-myristyloxy-benzamide Formula: C32H45N2O2S+ MolecularWeight: 521.7769

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3C

InChI

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