ethyl (Z)-2-azanyl-3-cyclopropylcarbonyl-4-[2-methylsulfanyl-4-(trifluoromethyl)phenyl]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (Z)-2-azanyl-3-cyclopropylcarbonyl-4-[2-methylsulfanyl-4-(trifluoromethyl)phenyl]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (Z)-2-amino-3-(cyclopropanecarbonyl)-4-[2-methylsulfanyl-4-(trifluoromethyl)phenyl]-4-oxo-but-2-enoate CAS Name: (Z)-2-amino-3-[cyclopropyl(oxo)methyl]-4-[2-(methylthio)-4-(trifluoromethyl)phenyl]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-amino-3-(cyclopropanecarbonyl)-4-[2-methylsulfanyl-4-(trifluoromethyl)phenyl]-4-oxobut-2-enoate Traditional Name: (Z)-2-amino-3-(cyclopropanecarbonyl)-4-keto-4-[2-(methylthio)-4-(trifluoromethyl)phenyl]but-2-enoic acid ethyl ester Formula: C18H18F3NO4S MolecularWeight: 401.40003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C(=O)C1CC1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)SC)N

Isomeric SMILES

CCOC(=O)/C(=C(\C(=O)C1CC1)/C(=O)C2=C(C=C(C=C2)C(F)(F)F)SC)/N

InChI

InChI=1S/C18H18F3NO4S/c1-3-26-17(25)14(22)13(15(23)9-4-5-9)16(24)11-7-6-10(18(19,20)21)8-12(11)27-2/h6-9H,3-5,22H2,1-2H3/b14-13-