2-(4-tert-butylphenyl)carbonyl-3,3-bis(methylsulfanyl)prop-2-enenitrile

Systemtic Name: 2-(4-tert-butylphenyl)carbonyl-3,3-bis(methylsulfanyl)prop-2-enenitrile Openeye Name: 2-(4-tert-butylbenzoyl)-3,3-bis(methylsulfanyl)prop-2-enenitrile CAS Name: 2-[(4-tert-butylphenyl)-oxomethyl]-3,3-bis(methylthio)-2-propenenitrile IUPAC Name: 2-(4-tert-butylbenzoyl)-3,3-bis(methylsulfanyl)prop-2-enenitrile Traditional Name: 2-(4-tert-butylbenzoyl)-3,3-bis(methylthio)acrylonitrile Formula: C16H19NOS2 MolecularWeight: 305.45816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NOS2/c1-16(2,3)12-8-6-11(7-9-12)14(18)13(10-17)15(19-4)20-5/h6-9H,1-5H3