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

Systemtic Name: 8-oxidanylidene-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-9-(phenylmethyl)-1,7-dihydropurine-6-carboxamide Openeye Name: 9-benzyl-8-oxo-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide CAS Name: 8-oxo-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-9-(phenylmethyl)-1,7-dihydropurine-6-carboxamide IUPAC Name: 9-benzyl-8-oxo-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Traditional Name: 9-benzyl-8-keto-2-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,7-dihydropurine-6-carboxamide Formula: C19H15N5O3 MolecularWeight: 361.3541

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC(=C4C=CC(=O)C=C4)NC(=C3NC2=O)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC(=C4C=CC(=O)C=C4)NC(=C3NC2=O)C(=O)N

InChI

InChI=1S/C19H15N5O3/c20-16(26)14-15-18(23-17(21-14)12-6-8-13(25)9-7-12)24(19(27)22-15)10-11-4-2-1-3-5-11/h1-9,21H,10H2,(H2,20,26)(H,22,27)