ethyl (Z)-3-tert-butylsulfanyl-3-[(4-ethylphenyl)amino]-2-(trifluoromethyl)prop-2-enoate

Systemtic Name: ethyl (Z)-3-tert-butylsulfanyl-3-[(4-ethylphenyl)amino]-2-(trifluoromethyl)prop-2-enoate Openeye Name: ethyl (Z)-3-tert-butylsulfanyl-3-(4-ethylanilino)-2-(trifluoromethyl)prop-2-enoate CAS Name: (Z)-3-(tert-butylthio)-3-(4-ethylanilino)-2-(trifluoromethyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-tert-butylsulfanyl-3-(4-ethylanilino)-2-(trifluoromethyl)prop-2-enoate Traditional Name: (Z)-3-(tert-butylthio)-3-(4-ethylanilino)-2-(trifluoromethyl)acrylic acid ethyl ester Formula: C18H24F3NO2S MolecularWeight: 375.44887

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=C(C(=O)OCC)C(F)(F)F)SC(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N/C(=C(\C(=O)OCC)/C(F)(F)F)/SC(C)(C)C

InChI

InChI=1S/C18H24F3NO2S/c1-6-12-8-10-13(11-9-12)22-15(25-17(3,4)5)14(18(19,20)21)16(23)24-7-2/h8-11,22H,6-7H2,1-5H3/b15-14-