2,4-bis(chloranyl)-N-[2,4,6-tris(oxidanylidene)-1-phenethyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[2,4,6-tris(oxidanylidene)-1-phenethyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide Openeye Name: 2,4-dichloro-N-[2,4,6-trioxo-1-phenethyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide CAS Name: 2,4-dichloro-N-[2,4,6-trioxo-1-phenethyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide IUPAC Name: 2,4-dichloro-N-[2,4,6-trioxo-1-phenethyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide Traditional Name: 2,4-dichloro-N-[2,4,6-triketo-1-phenethyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide Formula: C22H15Cl2F3N4O4 MolecularWeight: 527.28011

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NC(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NC(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H15Cl2F3N4O4/c23-12-6-7-13(14(24)10-12)17(32)30-21(22(25,26)27)15-16(28-19(21)34)31(20(35)29-18(15)33)9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,28,34)(H,30,32)(H,29,33,35)