3,3-bis(methylsulfanyl)-2-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]carbonyl-prop-2-enenitrile

Systemtic Name: 3,3-bis(methylsulfanyl)-2-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]carbonyl-prop-2-enenitrile Openeye Name: 3,3-bis(methylsulfanyl)-2-[4-phenyl-5-(trifluoromethyl)thiophene-2-carbonyl]prop-2-enenitrile CAS Name: 3,3-bis(methylthio)-2-[oxo-[4-phenyl-5-(trifluoromethyl)-2-thiophenyl]methyl]-2-propenenitrile IUPAC Name: 3,3-bis(methylsulfanyl)-2-[4-phenyl-5-(trifluoromethyl)thiophene-2-carbonyl]prop-2-enenitrile Traditional Name: 3,3-bis(methylthio)-2-[4-phenyl-5-(trifluoromethyl)thiophene-2-carbonyl]acrylonitrile Formula: C17H12F3NOS3 MolecularWeight: 399.47349

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C(=O)C1=CC(=C(S1)C(F)(F)F)C2=CC=CC=C2)SC

Isomeric SMILES

CSC(=C(C#N)C(=O)C1=CC(=C(S1)C(F)(F)F)C2=CC=CC=C2)SC

InChI

InChI=1S/C17H12F3NOS3/c1-23-16(24-2)12(9-21)14(22)13-8-11(10-6-4-3-5-7-10)15(25-13)17(18,19)20/h3-8H,1-2H3