(E)-N-ethyl-6,6-dimethyl-N-[[3-[(5-thiophen-3-ylthiophen-3-yl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(5-thiophen-3-ylthiophen-3-yl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[[5-(3-thienyl)-3-thienyl]methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[[5-(3-thiophenyl)-3-thiophenyl]methoxy]phenyl]methyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(5-thiophen-3-ylthiophen-3-yl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-[3-[[5-(3-thienyl)-3-thienyl]methoxy]benzyl]amine Formula: C27H31NOS2 MolecularWeight: 449.67114

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=CC#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CSC(=C2)C3=CSC=C3

Isomeric SMILES

CCN(C/C=C/C#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CSC(=C2)C3=CSC=C3

InChI

InChI=1S/C27H31NOS2/c1-5-28(14-8-6-7-13-27(2,3)4)18-22-10-9-11-25(16-22)29-19-23-17-26(31-20-23)24-12-15-30-21-24/h6,8-12,15-17,20-21H,5,14,18-19H2,1-4H3/b8-6+