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

Systemtic Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(E)-4-thiophen-3-ylbut-3-enoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(E)-4-(3-thienyl)but-3-enoxy]phenyl]methyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(E)-4-(3-thiophenyl)but-3-enoxy]phenyl]methyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(E)-4-thiophen-3-ylbut-3-enoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-[3-[(E)-4-(3-thienyl)but-3-enoxy]benzyl]amine Formula: C26H33NOS MolecularWeight: 407.61132

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=CC#CC(C)(C)C)CC1=CC(=CC=C1)OCCC=CC2=CSC=C2

Isomeric SMILES

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

InChI

InChI=1S/C26H33NOS/c1-5-27(17-9-6-8-16-26(2,3)4)21-24-13-11-14-25(20-24)28-18-10-7-12-23-15-19-29-22-23/h6-7,9,11-15,19-20,22H,5,10,17-18,21H2,1-4H3/b9-6+,12-7+