5-azanyl-3-methyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one

Systemtic Name: 5-azanyl-3-methyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Openeye Name: 5-amino-3-methyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one CAS Name: 5-amino-3-methyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one IUPAC Name: 5-amino-3-methyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Traditional Name: 5-amino-3-methyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Formula: C12H11N5O MolecularWeight: 241.24864

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C2C(=NC3=CC=CC=C3NC2=NC1=O)N

Isomeric SMILES

CN1C=C2C(=NC3=CC=CC=C3NC2=NC1=O)N

InChI

InChI=1S/C12H11N5O/c1-17-6-7-10(13)14-8-4-2-3-5-9(8)15-11(7)16-12(17)18/h2-6H,1H3,(H2,13,14)(H,15,16,18)