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

Systemtic Name: ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-[(4-phenylazanylphenyl)amino]ethyl]-2-(phenylmethylsulfanyl)pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(4-anilinoanilino)-2-oxo-ethyl]-2-benzylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-[2-(4-anilinoanilino)-2-oxoethyl]-6-oxo-2-(phenylmethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-anilinoanilino)-2-oxoethyl]-2-benzylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 1-[2-(4-anilinoanilino)-2-keto-ethyl]-2-(benzylthio)-6-keto-pyrimidine-5-carboxylic acid ethyl ester Formula: C28H26N4O4S MolecularWeight: 514.59544

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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)SCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C28H26N4O4S/c1-2-36-27(35)24-17-29-28(37-19-20-9-5-3-6-10-20)32(26(24)34)18-25(33)31-23-15-13-22(14-16-23)30-21-11-7-4-8-12-21/h3-17,30H,2,18-19H2,1H3,(H,31,33)