N-[4-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-1-methyl-2-oxidanylidene-5-pyridin-2-yl-pyrrolidine-3-carboxamide

Systemtic Name: N-[4-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-1-methyl-2-oxidanylidene-5-pyridin-2-yl-pyrrolidine-3-carboxamide Openeye Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-1-methyl-2-oxo-5-(2-pyridyl)pyrrolidine-3-carboxamide CAS Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-1-methyl-2-oxo-5-(2-pyridinyl)-3-pyrrolidinecarboxamide IUPAC Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-1-methyl-2-oxo-5-pyridin-2-ylpyrrolidine-3-carboxamide Traditional Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-keto-1H-pyrimidin-6-yl]phenyl]-2-keto-1-methyl-5-(2-pyridyl)pyrrolidine-3-carboxamide Formula: C28H22ClN7O3 MolecularWeight: 539.97238

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(C1=O)C(=O)NC2=CC=C(C=C2)C3=C(C(=O)N=C(N3)NC4=CC=C(C=C4)Cl)C#N)C5=CC=CC=N5

Isomeric SMILES

CN1C(CC(C1=O)C(=O)NC2=CC=C(C=C2)C3=C(C(=O)N=C(N3)NC4=CC=C(C=C4)Cl)C#N)C5=CC=CC=N5

InChI

InChI=1S/C28H22ClN7O3/c1-36-23(22-4-2-3-13-31-22)14-20(27(36)39)25(37)32-18-9-5-16(6-10-18)24-21(15-30)26(38)35-28(34-24)33-19-11-7-17(29)8-12-19/h2-13,20,23H,14H2,1H3,(H,32,37)(H2,33,34,35,38)