(E)-N-ethyl-6,6-dimethyl-N-[[3-[(5-thiophen-3-ylthiophen-2-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-2-yl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[[5-(3-thienyl)-2-thienyl]methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[[5-(3-thiophenyl)-2-thiophenyl]methoxy]phenyl]methyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(5-thiophen-3-ylthiophen-2-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)-2-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=CC=C(S2)C3=CSC=C3

Isomeric SMILES

CCN(C/C=C/C#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC=C(S2)C3=CSC=C3

InChI

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