ethyl 2-[(2-chlorophenyl)methylsulfanyl]-1-[2-(diphenylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[(2-chlorophenyl)methylsulfanyl]-1-[2-(diphenylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[(2-chlorophenyl)methylsulfanyl]-6-oxo-1-[2-oxo-2-(N-phenylanilino)ethyl]pyrimidine-5-carboxylate CAS Name: 2-[(2-chlorophenyl)methylthio]-6-oxo-1-[2-oxo-2-(N-phenylanilino)ethyl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chlorophenyl)methylsulfanyl]-6-oxo-1-[2-oxo-2-(N-phenylanilino)ethyl]pyrimidine-5-carboxylate Traditional Name: 2-[(2-chlorobenzyl)thio]-6-keto-1-[2-keto-2-(N-phenylanilino)ethyl]pyrimidine-5-carboxylic acid ethyl ester Formula: C28H24ClN3O4S MolecularWeight: 534.02586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)SCC4=CC=CC=C4Cl

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)SCC4=CC=CC=C4Cl

InChI

InChI=1S/C28H24ClN3O4S/c1-2-36-27(35)23-17-30-28(37-19-20-11-9-10-16-24(20)29)31(26(23)34)18-25(33)32(21-12-5-3-6-13-21)22-14-7-4-8-15-22/h3-17H,2,18-19H2,1H3