(E)-N-ethyl-6-methoxy-6-methyl-N-[[3-[(3-thiophen-3-ylphenyl)sulfanylmethyl]phenyl]methyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N-ethyl-6-methoxy-6-methyl-N-[[3-[(3-thiophen-3-ylphenyl)sulfanylmethyl]phenyl]methyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-ethyl-6-methoxy-6-methyl-N-[[3-[[3-(3-thienyl)phenyl]sulfanylmethyl]phenyl]methyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N-ethyl-6-methoxy-6-methyl-N-[[3-[[[3-(3-thiophenyl)phenyl]thio]methyl]phenyl]methyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-ethyl-6-methoxy-6-methyl-N-[[3-[(3-thiophen-3-ylphenyl)sulfanylmethyl]phenyl]methyl]hept-2-en-4-yn-1-amine Traditional Name: ethyl-[(E)-6-methoxy-6-methyl-hept-2-en-4-ynyl]-[3-[[[3-(3-thienyl)phenyl]thio]methyl]benzyl]amine Formula: C29H33NOS2 MolecularWeight: 475.70842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=CC#CC(C)(C)OC)CC1=CC(=CC=C1)CSC2=CC=CC(=C2)C3=CSC=C3

Isomeric SMILES

CCN(C/C=C/C#CC(C)(C)OC)CC1=CC(=CC=C1)CSC2=CC=CC(=C2)C3=CSC=C3

InChI

InChI=1S/C29H33NOS2/c1-5-30(17-8-6-7-16-29(2,3)31-4)21-24-11-9-12-25(19-24)22-33-28-14-10-13-26(20-28)27-15-18-32-23-27/h6,8-15,18-20,23H,5,17,21-22H2,1-4H3/b8-6+