(2E,4Z)-2-[(E)-3-ethoxy-1-oxidanyl-2-phenylsulfanyl-prop-2-enyl]-6,6-dimethyl-4-phenylsulfanyl-hepta-2,4-dienenitrile

Systemtic Name: (2E,4Z)-2-[(E)-3-ethoxy-1-oxidanyl-2-phenylsulfanyl-prop-2-enyl]-6,6-dimethyl-4-phenylsulfanyl-hepta-2,4-dienenitrile Openeye Name: (2E,4Z)-2-[(E)-3-ethoxy-1-hydroxy-2-phenylsulfanyl-allyl]-6,6-dimethyl-4-phenylsulfanyl-hepta-2,4-dienenitrile CAS Name: (2E,4Z)-2-[(E)-3-ethoxy-1-hydroxy-2-(phenylthio)prop-2-enyl]-6,6-dimethyl-4-(phenylthio)hepta-2,4-dienenitrile IUPAC Name: (2E,4Z)-2-[(E)-3-ethoxy-1-hydroxy-2-phenylsulfanylprop-2-enyl]-6,6-dimethyl-4-phenylsulfanylhepta-2,4-dienenitrile Traditional Name: (2E,4Z)-2-[(E)-3-ethoxy-1-hydroxy-2-(phenylthio)allyl]-6,6-dimethyl-4-(phenylthio)hepta-2,4-dienenitrile Formula: C26H29NO2S2 MolecularWeight: 451.64396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC=C(C(C(=CC(=CC(C)(C)C)SC1=CC=CC=C1)C#N)O)SC2=CC=CC=C2

Isomeric SMILES

CCO/C=C(\C(/C(=C/C(=C/C(C)(C)C)/SC1=CC=CC=C1)/C#N)O)/SC2=CC=CC=C2

InChI

InChI=1S/C26H29NO2S2/c1-5-29-19-24(31-22-14-10-7-11-15-22)25(28)20(18-27)16-23(17-26(2,3)4)30-21-12-8-6-9-13-21/h6-17,19,25,28H,5H2,1-4H3/b20-16+,23-17-,24-19+