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

Systemtic Name: 5-azanyl-3-ethyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Openeye Name: 5-amino-3-ethyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one CAS Name: 5-amino-3-ethyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one IUPAC Name: 5-amino-3-ethyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Traditional Name: 5-amino-3-ethyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Formula: C13H13N5O MolecularWeight: 255.27522

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C2C(=NC3=CC=CC=C3NC2=NC1=O)N

Isomeric SMILES

CCN1C=C2C(=NC3=CC=CC=C3NC2=NC1=O)N

InChI

InChI=1S/C13H13N5O/c1-2-18-7-8-11(14)15-9-5-3-4-6-10(9)16-12(8)17-13(18)19/h3-7H,2H2,1H3,(H2,14,15)(H,16,17,19)