N-[(4-tert-butyl-3-tetradecoxy-phenyl)methyl]-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide

Systemtic Name: N-[(4-tert-butyl-3-tetradecoxy-phenyl)methyl]-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]ethanamide Openeye Name: N-[(4-tert-butyl-3-tetradecoxy-phenyl)methyl]-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide CAS Name: N-[(4-tert-butyl-3-tetradecoxyphenyl)methyl]-N-[3-(3-thiazol-3-iumylmethyl)phenyl]acetamide IUPAC Name: N-[(4-tert-butyl-3-tetradecoxyphenyl)methyl]-N-[3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]acetamide Traditional Name: N-(4-tert-butyl-3-myristyloxy-benzyl)-N-[3-(thiazol-3-ium-3-ylmethyl)phenyl]acetamide Formula: C37H55N2O2S+ MolecularWeight: 591.9098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H55N2O2S/c1-6-7-8-9-10-11-12-13-14-15-16-17-24-41-36-27-33(21-22-35(36)37(3,4)5)29-39(31(2)40)34-20-18-19-32(26-34)28-38-23-25-42-30-38/h18-23,25-27,30H,6-17,24,28-29H2,1-5H3/q+1