(1-dodecylsulfanyl-3-phenyl-prop-2-ynyl)benzene

Systemtic Name: (1-dodecylsulfanyl-3-phenyl-prop-2-ynyl)benzene Openeye Name: (1-dodecylsulfanyl-3-phenyl-prop-2-ynyl)benzene CAS Name: [1-(dodecylthio)-3-phenylprop-2-ynyl]benzene IUPAC Name: (1-dodecylsulfanyl-3-phenylprop-2-ynyl)benzene Traditional Name: [1-(laurylthio)-3-phenyl-prop-2-ynyl]benzene Formula: C27H36S MolecularWeight: 392.63974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C#CC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCSC(C#CC1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C27H36S/c1-2-3-4-5-6-7-8-9-10-17-24-28-27(26-20-15-12-16-21-26)23-22-25-18-13-11-14-19-25/h11-16,18-21,27H,2-10,17,24H2,1H3