3-tert-butyl-2-tetradecoxy-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide

Systemtic Name: 3-tert-butyl-2-tetradecoxy-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide Openeye Name: 3-tert-butyl-2-tetradecoxy-N-[4-(thiazol-3-ium-3-ylmethyl)phenyl]benzamide CAS Name: 3-tert-butyl-2-tetradecoxy-N-[4-(3-thiazol-3-iumylmethyl)phenyl]benzamide IUPAC Name: 3-tert-butyl-2-tetradecoxy-N-[4-(1,3-thiazol-3-ium-3-ylmethyl)phenyl]benzamide Traditional Name: 3-tert-butyl-2-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=C1C(C)(C)C)C(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1C(C)(C)C)C(=O)NC2=CC=C(C=C2)C[N+]3=CSC=C3

InChI

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