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

Systemtic Name: ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-[(4-phenylazanylphenyl)amino]ethyl]-2-phenethylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(4-anilinoanilino)-2-oxo-ethyl]-6-oxo-2-phenethylsulfanyl-pyrimidine-5-carboxylate CAS Name: 1-[2-(4-anilinoanilino)-2-oxoethyl]-6-oxo-2-(phenethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-anilinoanilino)-2-oxoethyl]-6-oxo-2-phenethylsulfanylpyrimidine-5-carboxylate Traditional Name: 1-[2-(4-anilinoanilino)-2-keto-ethyl]-6-keto-2-(phenethylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C29H28N4O4S MolecularWeight: 528.62202

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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)NC3=CC=CC=C3)SCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)SCCC4=CC=CC=C4

InChI

InChI=1S/C29H28N4O4S/c1-2-37-28(36)25-19-30-29(38-18-17-21-9-5-3-6-10-21)33(27(25)35)20-26(34)32-24-15-13-23(14-16-24)31-22-11-7-4-8-12-22/h3-16,19,31H,2,17-18,20H2,1H3,(H,32,34)