9-(3,4-dichlorophenyl)-8-oxidanylidene-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide

Systemtic Name: 9-(3,4-dichlorophenyl)-8-oxidanylidene-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Openeye Name: 9-(3,4-dichlorophenyl)-8-oxo-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide CAS Name: 9-(3,4-dichlorophenyl)-8-oxo-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1,7-dihydropurine-6-carboxamide IUPAC Name: 9-(3,4-dichlorophenyl)-8-oxo-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Traditional Name: 9-(3,4-dichlorophenyl)-8-keto-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Formula: C18H11Cl2N5O3 MolecularWeight: 416.21764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C=C4)Cl)Cl)C(=O)N)C(=O)C=C1

Isomeric SMILES

C1=CC(=C2NC(=C3C(=N2)N(C(=O)N3)C4=CC(=C(C=C4)Cl)Cl)C(=O)N)C(=O)C=C1

InChI

InChI=1S/C18H11Cl2N5O3/c19-10-6-5-8(7-11(10)20)25-17-14(23-18(25)28)13(15(21)27)22-16(24-17)9-3-1-2-4-12(9)26/h1-7,22H,(H2,21,27)(H,23,28)