6-[methyl-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]amino]-3,7-dihydropurin-2-one

Systemtic Name: 6-[methyl-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]amino]-3,7-dihydropurin-2-one Openeye Name: 6-[methyl-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]amino]-3,7-dihydropurin-2-one CAS Name: 6-[methyl-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]amino]-3,7-dihydropurin-2-one IUPAC Name: 6-[methyl-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]amino]-3,7-dihydropurin-2-one Traditional Name: 6-[[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]-methyl-amino]-3,7-dihydropurin-2-one Formula: C13H12N6O2 MolecularWeight: 284.27338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC(=O)NC2=C1NC=N2)NC=C3C=CC(=O)C=C3

Isomeric SMILES

CN(C1=NC(=O)NC2=C1NC=N2)NC=C3C=CC(=O)C=C3

InChI

InChI=1S/C13H12N6O2/c1-19(16-6-8-2-4-9(20)5-3-8)12-10-11(15-7-14-10)17-13(21)18-12/h2-7,16H,1H3,(H2,14,15,17,18,21)