N-[4-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[4-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[4-[2-(4-chloroanilino)-5-cyano-4-keto-1H-pyrimidin-6-yl]phenyl]-5-nitro-2-furamide Formula: C22H13ClN6O5 MolecularWeight: 476.82882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=O)N=C(N2)NC3=CC=C(C=C3)Cl)C#N)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=O)N=C(N2)NC3=CC=C(C=C3)Cl)C#N)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C22H13ClN6O5/c23-13-3-7-15(8-4-13)26-22-27-19(16(11-24)20(30)28-22)12-1-5-14(6-2-12)25-21(31)17-9-10-18(34-17)29(32)33/h1-10H,(H,25,31)(H2,26,27,28,30)