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

Systemtic Name: 3,3-bis(methylsulfanyl)-2-(4-phenylmethoxyphenyl)carbonyl-prop-2-enenitrile Openeye Name: 2-(4-benzyloxybenzoyl)-3,3-bis(methylsulfanyl)prop-2-enenitrile CAS Name: 3,3-bis(methylthio)-2-[oxo-(4-phenylmethoxyphenyl)methyl]-2-propenenitrile IUPAC Name: 3,3-bis(methylsulfanyl)-2-(4-phenylmethoxybenzoyl)prop-2-enenitrile Traditional Name: 2-(4-benzoxybenzoyl)-3,3-bis(methylthio)acrylonitrile Formula: C19H17NO2S2 MolecularWeight: 355.47378

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2)SC

Isomeric SMILES

CSC(=C(C#N)C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2)SC

InChI

InChI=1S/C19H17NO2S2/c1-23-19(24-2)17(12-20)18(21)15-8-10-16(11-9-15)22-13-14-6-4-3-5-7-14/h3-11H,13H2,1-2H3