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

Systemtic Name: ethyl 6-oxidanylidene-1-[2-oxidanylidene-2-[(4-propoxycarbonylphenyl)amino]ethyl]-2-(phenylmethylsulfanyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-benzylsulfanyl-6-oxo-1-[2-oxo-2-(4-propoxycarbonylanilino)ethyl]pyrimidine-5-carboxylate CAS Name: 6-oxo-1-[2-oxo-2-[4-[oxo(propoxy)methyl]anilino]ethyl]-2-(phenylmethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-6-oxo-1-[2-oxo-2-(4-propoxycarbonylanilino)ethyl]pyrimidine-5-carboxylate Traditional Name: 2-(benzylthio)-6-keto-1-[2-keto-2-(4-propoxycarbonylanilino)ethyl]pyrimidine-5-carboxylic acid ethyl ester Formula: C26H27N3O6S MolecularWeight: 509.57408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CN=C2SCC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CN=C2SCC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C26H27N3O6S/c1-3-14-35-24(32)19-10-12-20(13-11-19)28-22(30)16-29-23(31)21(25(33)34-4-2)15-27-26(29)36-17-18-8-6-5-7-9-18/h5-13,15H,3-4,14,16-17H2,1-2H3,(H,28,30)