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

Systemtic Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(E)-2-[3-(1,3-thiazol-5-yl)phenyl]ethenyl]phenyl]methyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(E)-2-(3-thiazol-5-ylphenyl)vinyl]phenyl]methyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(E)-2-[3-(5-thiazolyl)phenyl]ethenyl]phenyl]methyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-ethyl-6,6-dimethyl-N-[[3-[(E)-2-[3-(1,3-thiazol-5-yl)phenyl]ethenyl]phenyl]methyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-[3-[(E)-2-(3-thiazol-5-ylphenyl)vinyl]benzyl]amine Formula: C29H32N2S MolecularWeight: 440.64278

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=CC#CC(C)(C)C)CC1=CC=CC(=C1)C=CC2=CC=CC(=C2)C3=CN=CS3

Isomeric SMILES

CCN(C/C=C/C#CC(C)(C)C)CC1=CC=CC(=C1)/C=C/C2=CC=CC(=C2)C3=CN=CS3

InChI

InChI=1S/C29H32N2S/c1-5-31(18-8-6-7-17-29(2,3)4)22-26-13-9-11-24(19-26)15-16-25-12-10-14-27(20-25)28-21-30-23-32-28/h6,8-16,19-21,23H,5,18,22H2,1-4H3/b8-6+,16-15+