propyl 2-[[5-(2-butoxy-2-oxidanylidene-ethyl)sulfanyl-4-chloranyl-2-fluoranyl-phenyl]-(2-chloranylethanoyl)carbamoyl]cyclohexene-1-carboxylate

Systemtic Name: propyl 2-[[5-(2-butoxy-2-oxidanylidene-ethyl)sulfanyl-4-chloranyl-2-fluoranyl-phenyl]-(2-chloranylethanoyl)carbamoyl]cyclohexene-1-carboxylate Openeye Name: propyl 2-[[5-(2-butoxy-2-oxo-ethyl)sulfanyl-4-chloro-2-fluoro-phenyl]-(2-chloroacetyl)carbamoyl]cyclohexene-1-carboxylate CAS Name: 2-[[5-[(2-butoxy-2-oxoethyl)thio]-4-chloro-N-(2-chloro-1-oxoethyl)-2-fluoroanilino]-oxomethyl]-1-cyclohexenecarboxylic acid propyl ester IUPAC Name: propyl 2-[[5-(2-butoxy-2-oxoethyl)sulfanyl-4-chloro-2-fluorophenyl]-(2-chloroacetyl)carbamoyl]cyclohexene-1-carboxylate Traditional Name: 2-[[5-[(2-butoxy-2-keto-ethyl)thio]-4-chloro-2-fluoro-phenyl]-(2-chloroacetyl)carbamoyl]cyclohexene-1-carboxylic acid propyl ester Formula: C25H30Cl2FNO6S MolecularWeight: 562.478203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=C(C=C(C(=C1)N(C(=O)CCl)C(=O)C2=C(CCCC2)C(=O)OCCC)F)Cl

Isomeric SMILES

CCCCOC(=O)CSC1=C(C=C(C(=C1)N(C(=O)CCl)C(=O)C2=C(CCCC2)C(=O)OCCC)F)Cl

InChI

InChI=1S/C25H30Cl2FNO6S/c1-3-5-11-34-23(31)15-36-21-13-20(19(28)12-18(21)27)29(22(30)14-26)24(32)16-8-6-7-9-17(16)25(33)35-10-4-2/h12-13H,3-11,14-15H2,1-2H3