6-Acetyl-2-amino-3,7,8,9-tetrahydro-4H-pyrimido[4,5-b][1,4]diazepin-4-one
CAS Registry Number®
80003-63-0
CAS Name
6-Acetyl-2-amino-3,7,8,9-tetrahydro-4H-pyrimido[4,5-b][1,4]diazepin-4-oneMolecular Formula
C9H11N5O2Molecular Mass
221.22Cite this Page
6-Acetyl-2-amino-3,7,8,9-tetrahydro-4H-pyrimido[4,5-b][1,4]diazepin-4-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=80003-63-0 (retrieved ) (CAS RN: 80003-63-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
165 °C (decomp)
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C9H11N5O2/c1-4(15)5-2-3-11-7-6(12-5)8(16)14-9(10)13-7/h2-3H2,1H3,(H4,10,11,13,14,16)
InChIKey
InChIKey=XEAAIJWYCBLWNK-UHFFFAOYSA-N
SMILES
O=C1C2=C(NC(N)=N1)NCCC(C(C)=O)=N2
Canonical SMILES
O=C1N=C(N)NC=2NCCC(=NC12)C(=O)C
Other Names for this Substance
- 4H-Pyrimido[4,5-b][1,4]diazepin-4-one, 6-acetyl-2-amino-3,7,8,9-tetrahydro-
- 4H-Pyrimido[4,5-b][1,4]diazepin-4-one, 6-acetyl-2-amino-1,7,8,9-tetrahydro-
- 6-Acetyl-2-amino-3,7,8,9-tetrahydro-4H-pyrimido[4,5-b][1,4]diazepin-4-one