9-(3,4-dimethylphenyl)-8-oxidanylidene-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide

Systemtic Name: 9-(3,4-dimethylphenyl)-8-oxidanylidene-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Openeye Name: 9-(3,4-dimethylphenyl)-8-oxo-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide CAS Name: 9-(3,4-dimethylphenyl)-8-oxo-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,7-dihydropurine-6-carboxamide IUPAC Name: 9-(3,4-dimethylphenyl)-8-oxo-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Traditional Name: 9-(3,4-dimethylphenyl)-8-keto-2-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Formula: C20H17N5O3 MolecularWeight: 375.38068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=NC(=C4C=CC(=O)C=C4)NC(=C3NC2=O)C(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=NC(=C4C=CC(=O)C=C4)NC(=C3NC2=O)C(=O)N)C

InChI

InChI=1S/C20H17N5O3/c1-10-3-6-13(9-11(10)2)25-19-16(23-20(25)28)15(17(21)27)22-18(24-19)12-4-7-14(26)8-5-12/h3-9,22H,1-2H3,(H2,21,27)(H,23,28)