N-[3-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-7-nitro-1H-indole-2-carboxamide

Systemtic Name: N-[3-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]-7-nitro-1H-indole-2-carboxamide Openeye Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-7-nitro-1H-indole-2-carboxamide CAS Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-7-nitro-1H-indole-2-carboxamide IUPAC Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-7-nitro-1H-indole-2-carboxamide Traditional Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-keto-1H-pyrimidin-6-yl]phenyl]-7-nitro-1H-indole-2-carboxamide Formula: C26H16ClN7O4 MolecularWeight: 525.90274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC3=C(N2)C(=CC=C3)[N+](=O)[O-])C4=C(C(=O)N=C(N4)NC5=CC=C(C=C5)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC3=C(N2)C(=CC=C3)[N+](=O)[O-])C4=C(C(=O)N=C(N4)NC5=CC=C(C=C5)Cl)C#N

InChI

InChI=1S/C26H16ClN7O4/c27-16-7-9-17(10-8-16)30-26-32-22(19(13-28)24(35)33-26)14-3-1-5-18(11-14)29-25(36)20-12-15-4-2-6-21(34(37)38)23(15)31-20/h1-12,31H,(H,29,36)(H2,30,32,33,35)