2-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-9-(4-chlorophenyl)-8-oxidanylidene-1,7-dihydropurine-6-carboxamide

Systemtic Name: 2-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-9-(4-chlorophenyl)-8-oxidanylidene-1,7-dihydropurine-6-carboxamide Openeye Name: 2-(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)-9-(4-chlorophenyl)-8-oxo-1,7-dihydropurine-6-carboxamide CAS Name: 2-(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)-9-(4-chlorophenyl)-8-oxo-1,7-dihydropurine-6-carboxamide IUPAC Name: 2-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)-9-(4-chlorophenyl)-8-oxo-1,7-dihydropurine-6-carboxamide Traditional Name: 2-(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)-9-(4-chlorophenyl)-8-keto-1,7-dihydropurine-6-carboxamide Formula: C18H11BrClN5O3 MolecularWeight: 460.66864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C3=NC(=C4C=C(C=CC4=O)Br)NC(=C3NC2=O)C(=O)N)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C3=NC(=C4C=C(C=CC4=O)Br)NC(=C3NC2=O)C(=O)N)Cl

InChI

InChI=1S/C18H11BrClN5O3/c19-8-1-6-12(26)11(7-8)16-22-13(15(21)27)14-17(24-16)25(18(28)23-14)10-4-2-9(20)3-5-10/h1-7,22H,(H2,21,27)(H,23,28)