ethyl 1-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-phenethylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-phenethylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]-6-oxo-2-phenethylsulfanyl-pyrimidine-5-carboxylate CAS Name: 1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-6-oxo-2-(phenethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-6-oxo-2-phenethylsulfanylpyrimidine-5-carboxylate Traditional Name: 1-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]-6-keto-2-(phenethylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C24H24ClN3O5S MolecularWeight: 501.98246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=C(C=CC(=C2)Cl)OC)SCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=C(C=CC(=C2)Cl)OC)SCCC3=CC=CC=C3

InChI

InChI=1S/C24H24ClN3O5S/c1-3-33-23(31)18-14-26-24(34-12-11-16-7-5-4-6-8-16)28(22(18)30)15-21(29)27-19-13-17(25)9-10-20(19)32-2/h4-10,13-14H,3,11-12,15H2,1-2H3,(H,27,29)