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

Systemtic Name: 2-(4-chlorophenyl)carbonyl-3,3-bis(propan-2-ylsulfanyl)prop-2-enenitrile Openeye Name: 2-(4-chlorobenzoyl)-3,3-bis(isopropylsulfanyl)prop-2-enenitrile CAS Name: 2-[(4-chlorophenyl)-oxomethyl]-3,3-bis(propan-2-ylthio)-2-propenenitrile IUPAC Name: 2-(4-chlorobenzoyl)-3,3-bis(propan-2-ylsulfanyl)prop-2-enenitrile Traditional Name: 2-(4-chlorobenzoyl)-3,3-bis(isopropylthio)acrylonitrile Formula: C16H18ClNOS2 MolecularWeight: 339.90322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(=C(C#N)C(=O)C1=CC=C(C=C1)Cl)SC(C)C

Isomeric SMILES

CC(C)SC(=C(C#N)C(=O)C1=CC=C(C=C1)Cl)SC(C)C

InChI

InChI=1S/C16H18ClNOS2/c1-10(2)20-16(21-11(3)4)14(9-18)15(19)12-5-7-13(17)8-6-12/h5-8,10-11H,1-4H3