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

Systemtic Name: 4-tert-butyl-3-tetradecoxy-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide Openeye Name: 4-tert-butyl-3-tetradecoxy-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]benzamide CAS Name: 4-tert-butyl-3-tetradecoxy-N-[4-(3-thiazol-3-iumylmethyl)phenyl]benzamide IUPAC Name: 4-tert-butyl-3-tetradecoxy-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide Traditional Name: 4-tert-butyl-3-myristyloxy-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]benzamide Formula: C35H51N2O2S+ MolecularWeight: 563.85664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3)C(C)(C)C

InChI

InChI=1S/C35H50N2O2S/c1-5-6-7-8-9-10-11-12-13-14-15-16-24-39-33-26-30(19-22-32(33)35(2,3)4)34(38)36-31-20-17-29(18-21-31)27-37-23-25-40-28-37/h17-23,25-26,28H,5-16,24,27H2,1-4H3/p+1