(E)-N-ethyl-6,6-dimethyl-N-[[2-(1,3-thiazol-4-ylmethoxy)-3-thiophen-3-yl-phenyl]methyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N-ethyl-6,6-dimethyl-N-[[2-(1,3-thiazol-4-ylmethoxy)-3-thiophen-3-yl-phenyl]methyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-ethyl-6,6-dimethyl-N-[[2-(thiazol-4-ylmethoxy)-3-(3-thienyl)phenyl]methyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N-ethyl-6,6-dimethyl-N-[[2-(4-thiazolylmethoxy)-3-(3-thiophenyl)phenyl]methyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-ethyl-6,6-dimethyl-N-[[2-(1,3-thiazol-4-ylmethoxy)-3-thiophen-3-ylphenyl]methyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-[2-(thiazol-4-ylmethoxy)-3-(3-thienyl)benzyl]amine Formula: C26H30N2OS2 MolecularWeight: 450.6592

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=CC#CC(C)(C)C)CC1=CC=CC(=C1OCC2=CSC=N2)C3=CSC=C3

Isomeric SMILES

CCN(C/C=C/C#CC(C)(C)C)CC1=CC=CC(=C1OCC2=CSC=N2)C3=CSC=C3

InChI

InChI=1S/C26H30N2OS2/c1-5-28(14-8-6-7-13-26(2,3)4)16-21-10-9-11-24(22-12-15-30-18-22)25(21)29-17-23-19-31-20-27-23/h6,8-12,15,18-20H,5,14,16-17H2,1-4H3/b8-6+