2-cyclopropylcarbonyl-3,3-bis[(2,4-dichlorophenyl)methylsulfanyl]prop-2-enal

Systemtic Name: 2-cyclopropylcarbonyl-3,3-bis[(2,4-dichlorophenyl)methylsulfanyl]prop-2-enal Openeye Name: 2-(cyclopropanecarbonyl)-3,3-bis[(2,4-dichlorophenyl)methylsulfanyl]prop-2-enal CAS Name: 2-[cyclopropyl(oxo)methyl]-3,3-bis[(2,4-dichlorophenyl)methylthio]-2-propenal IUPAC Name: 2-(cyclopropanecarbonyl)-3,3-bis[(2,4-dichlorophenyl)methylsulfanyl]prop-2-enal Traditional Name: 2-(cyclopropanecarbonyl)-3,3-bis[(2,4-dichlorobenzyl)thio]acrolein Formula: C21H16Cl4O2S2 MolecularWeight: 506.29254

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C(=C(SCC2=C(C=C(C=C2)Cl)Cl)SCC3=C(C=C(C=C3)Cl)Cl)C=O

Isomeric SMILES

C1CC1C(=O)C(=C(SCC2=C(C=C(C=C2)Cl)Cl)SCC3=C(C=C(C=C3)Cl)Cl)C=O

InChI

InChI=1S/C21H16Cl4O2S2/c22-15-5-3-13(18(24)7-15)10-28-21(17(9-26)20(27)12-1-2-12)29-11-14-4-6-16(23)8-19(14)25/h3-9,12H,1-2,10-11H2