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

Systemtic Name: (E)-3-methylsulfanyl-3-phenylazanyl-2-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]carbonyl-prop-2-enenitrile Openeye Name: (E)-3-anilino-3-methylsulfanyl-2-[4-phenyl-5-(trifluoromethyl)thiophene-2-carbonyl]prop-2-enenitrile CAS Name: (E)-3-anilino-3-(methylthio)-2-[oxo-[4-phenyl-5-(trifluoromethyl)-2-thiophenyl]methyl]-2-propenenitrile IUPAC Name: (E)-3-anilino-3-methylsulfanyl-2-[4-phenyl-5-(trifluoromethyl)thiophene-2-carbonyl]prop-2-enenitrile Traditional Name: (E)-3-anilino-3-(methylthio)-2-[4-phenyl-5-(trifluoromethyl)thiophene-2-carbonyl]acrylonitrile Formula: C22H15F3N2OS2 MolecularWeight: 444.49251

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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)NC3=CC=CC=C3

Isomeric SMILES

CS/C(=C(\C#N)/C(=O)C1=CC(=C(S1)C(F)(F)F)C2=CC=CC=C2)/NC3=CC=CC=C3

InChI

InChI=1S/C22H15F3N2OS2/c1-29-21(27-15-10-6-3-7-11-15)17(13-26)19(28)18-12-16(14-8-4-2-5-9-14)20(30-18)22(23,24)25/h2-12,27H,1H3/b21-17+