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

Systemtic Name: 5-azanyl-3-propyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Openeye Name: 5-amino-3-propyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one CAS Name: 5-amino-3-propyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one IUPAC Name: 5-amino-3-propyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Traditional Name: 5-amino-3-propyl-11H-pyrimido[4,5-b][1,5]benzodiazepin-2-one Formula: C14H15N5O MolecularWeight: 269.3018

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C2C(=NC3=CC=CC=C3NC2=NC1=O)N

Isomeric SMILES

CCCN1C=C2C(=NC3=CC=CC=C3NC2=NC1=O)N

InChI

InChI=1S/C14H15N5O/c1-2-7-19-8-9-12(15)16-10-5-3-4-6-11(10)17-13(9)18-14(19)20/h3-6,8H,2,7H2,1H3,(H2,15,16)(H,17,18,20)