[[3-(5-chloranyl-2-ethenylsulfanyl-phenyl)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]-methyl-phosphoryl]oxymethyl 2,2-dimethylpropanoate

Systemtic Name: [[3-(5-chloranyl-2-ethenylsulfanyl-phenyl)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]-methyl-phosphoryl]oxymethyl 2,2-dimethylpropanoate Openeye Name: [[2-anilino-1-[(5-chloro-2-vinylsulfanyl-phenyl)methyl]-2-oxo-ethyl]-methyl-phosphoryl]oxymethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [[1-anilino-3-[5-chloro-2-(ethenylthio)phenyl]-1-oxopropan-2-yl]-methylphosphoryl]oxymethyl ester IUPAC Name: [[1-anilino-3-(5-chloro-2-ethenylsulfanylphenyl)-1-oxopropan-2-yl]-methylphosphoryl]oxymethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [[2-anilino-1-[5-chloro-2-(vinylthio)benzyl]-2-keto-ethyl]-methyl-phosphoryl]oxymethyl ester Formula: C24H29ClNO5PS MolecularWeight: 509.982521

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOP(=O)(C)C(CC1=C(C=CC(=C1)Cl)SC=C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)OCOP(=O)(C)C(CC1=C(C=CC(=C1)Cl)SC=C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C24H29ClNO5PS/c1-6-33-21-13-12-18(25)14-17(21)15-20(22(27)26-19-10-8-7-9-11-19)32(5,29)31-16-30-23(28)24(2,3)4/h6-14,20H,1,15-16H2,2-5H3,(H,26,27)