ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-[(4-propan-2-yloxycarbonylphenyl)amino]ethyl]-2-phenethylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-[(4-propan-2-yloxycarbonylphenyl)amino]ethyl]-2-phenethylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(4-isopropoxycarbonylanilino)-2-oxo-ethyl]-6-oxo-2-phenethylsulfanyl-pyrimidine-5-carboxylate CAS Name: 6-oxo-1-[2-oxo-2-[4-[oxo(propan-2-yloxy)methyl]anilino]ethyl]-2-(phenethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-1-[2-oxo-2-(4-propan-2-yloxycarbonylanilino)ethyl]-2-phenethylsulfanylpyrimidine-5-carboxylate Traditional Name: 1-[2-(4-isopropoxycarbonylanilino)-2-keto-ethyl]-6-keto-2-(phenethylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C27H29N3O6S MolecularWeight: 523.60066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O6S/c1-4-35-26(34)22-16-28-27(37-15-14-19-8-6-5-7-9-19)30(24(22)32)17-23(31)29-21-12-10-20(11-13-21)25(33)36-18(2)3/h5-13,16,18H,4,14-15,17H2,1-3H3,(H,29,31)