(E)-3-(3,4-dibutyl-5-butylsulfanyl-thiophen-2-yl)prop-2-enal

Systemtic Name: (E)-3-(3,4-dibutyl-5-butylsulfanyl-thiophen-2-yl)prop-2-enal Openeye Name: (E)-3-(3,4-dibutyl-5-butylsulfanyl-2-thienyl)prop-2-enal CAS Name: (E)-3-[3,4-dibutyl-5-(butylthio)-2-thiophenyl]-2-propenal IUPAC Name: (E)-3-(3,4-dibutyl-5-butylsulfanylthiophen-2-yl)prop-2-enal Traditional Name: (E)-3-[3,4-dibutyl-5-(butylthio)-2-thienyl]acrolein Formula: C19H30OS2 MolecularWeight: 338.5709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(SC(=C1CCCC)SCCCC)C=CC=O

Isomeric SMILES

CCCCC1=C(SC(=C1CCCC)SCCCC)/C=C/C=O

InChI

InChI=1S/C19H30OS2/c1-4-7-11-16-17(12-8-5-2)19(21-15-9-6-3)22-18(16)13-10-14-20/h10,13-14H,4-9,11-12,15H2,1-3H3/b13-10+