(E)-6,6-dimethyl-N-[1-prop-2-enylsulfanyl-2-(3-thiophen-3-ylphenyl)ethyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-6,6-dimethyl-N-[1-prop-2-enylsulfanyl-2-(3-thiophen-3-ylphenyl)ethyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-[1-allylsulfanyl-2-[3-(3-thienyl)phenyl]ethyl]-6,6-dimethyl-hept-2-en-4-yn-1-amine CAS Name: (E)-6,6-dimethyl-N-[1-(prop-2-enylthio)-2-[3-(3-thiophenyl)phenyl]ethyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-6,6-dimethyl-N-[1-prop-2-enylsulfanyl-2-(3-thiophen-3-ylphenyl)ethyl]hept-2-en-4-yn-1-amine Traditional Name: [1-(allylthio)-2-[3-(3-thienyl)phenyl]ethyl]-[(E)-6,6-dimethylhept-2-en-4-ynyl]amine Formula: C24H29NS2 MolecularWeight: 395.62376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCNC(CC1=CC=CC(=C1)C2=CSC=C2)SCC=C

Isomeric SMILES

CC(C)(C)C#C/C=C/CNC(CC1=CC=CC(=C1)C2=CSC=C2)SCC=C

InChI

InChI=1S/C24H29NS2/c1-5-15-27-23(25-14-8-6-7-13-24(2,3)4)18-20-10-9-11-21(17-20)22-12-16-26-19-22/h5-6,8-12,16-17,19,23,25H,1,14-15,18H2,2-4H3/b8-6+