ethyl 1-[2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-phenethylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-phenethylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-oxo-ethyl]-6-oxo-2-phenethylsulfanyl-pyrimidine-5-carboxylate CAS Name: 1-[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]-6-oxo-2-(phenethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]-6-oxo-2-phenethylsulfanylpyrimidine-5-carboxylate Traditional Name: 1-[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-keto-ethyl]-6-keto-2-(phenethylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C25H26ClN3O5S MolecularWeight: 516.00904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26ClN3O5S/c1-4-34-24(32)18-14-27-25(35-11-10-17-8-6-5-7-9-17)29(23(18)31)15-22(30)28-20-12-16(2)19(26)13-21(20)33-3/h5-9,12-14H,4,10-11,15H2,1-3H3,(H,28,30)