(E)-2-(4-tert-butylphenyl)-3-ethoxycarbothioyloxy-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(4-tert-butylphenyl)-3-ethoxycarbothioyloxy-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile Openeye Name: (E)-2-(4-tert-butylphenyl)-3-ethoxycarbothioyloxy-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile CAS Name: (E)-2-(4-tert-butylphenyl)-3-[ethoxy(sulfanylidene)methoxy]-3-[2-(trifluoromethyl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(4-tert-butylphenyl)-3-ethoxycarbothioyloxy-3-[2-(trifluoromethyl)phenyl]prop-2-enenitrile Traditional Name: (E)-2-(4-tert-butylphenyl)-3-ethoxycarbothioyloxy-3-[2-(trifluoromethyl)phenyl]acrylonitrile Formula: C23H22F3NO2S MolecularWeight: 433.48649

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)OC(=C(C#N)C1=CC=C(C=C1)C(C)(C)C)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCOC(=S)O/C(=C(/C#N)\C1=CC=C(C=C1)C(C)(C)C)/C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C23H22F3NO2S/c1-5-28-21(30)29-20(17-8-6-7-9-19(17)23(24,25)26)18(14-27)15-10-12-16(13-11-15)22(2,3)4/h6-13H,5H2,1-4H3/b20-18-