2-(4-chlorophenyl)carbonyl-3,3-bis(ethylsulfanyl)prop-2-enenitrile

Systemtic Name: 2-(4-chlorophenyl)carbonyl-3,3-bis(ethylsulfanyl)prop-2-enenitrile Openeye Name: 2-(4-chlorobenzoyl)-3,3-bis(ethylsulfanyl)prop-2-enenitrile CAS Name: 2-[(4-chlorophenyl)-oxomethyl]-3,3-bis(ethylthio)-2-propenenitrile IUPAC Name: 2-(4-chlorobenzoyl)-3,3-bis(ethylsulfanyl)prop-2-enenitrile Traditional Name: 2-(4-chlorobenzoyl)-3,3-bis(ethylthio)acrylonitrile Formula: C14H14ClNOS2 MolecularWeight: 311.85006

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C(C#N)C(=O)C1=CC=C(C=C1)Cl)SCC

Isomeric SMILES

CCSC(=C(C#N)C(=O)C1=CC=C(C=C1)Cl)SCC

InChI

InChI=1S/C14H14ClNOS2/c1-3-18-14(19-4-2)12(9-16)13(17)10-5-7-11(15)8-6-10/h5-8H,3-4H2,1-2H3