Search MNXref
 Feedback

3-methyl-1-oxo-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,5-dihydrobenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile

PropertiesImage
MNX_IDMNXM1121411 Image of MNXM1121411
referencechebi:158799
formulaC20H20N4O2
global charge0
mol weight348.406
InChIKeyAEVYTKKOGUOZJH-UHFFFAOYSA-N
InChIInChI=1S/C20H20N4O2/c1-13-14(8-9-18(25)23-10-4-5-11-23)20(26)24-17-7-3-2-6-16(17)22-19(24)15(13)12-21/h2-3,6-7,22H,4-5,8-11H2,1H3
SMILESCC1=C(CCC(=O)N2CCCC2)C(=O)N2C3=C(C=CC=C3)NC2=C1C#N
MNX internals
InChI (mnx)InChI=1/C20H20N4O2/c1-13-14(8-9-18(25)23-10-4-5-11-23)20(26)24-17-7-3-2-6-16(17)22-19(24)15(13)12-21/h2-3,6-7,22H,4-5,8-11H2,1H3 Image of MNXM1121411
SMILES (mnx)[CH3:1][C:13]1=[C:14]([CH2:8][CH2:9][C:18]([N:23]2[CH2:10][CH2:4][CH2:5][CH2:11]2)=[O:25])[C:20](=[O:26])[N:24]2[C:17]3=[CH:7][CH:3]=[CH:2][CH:6]=[C:16]3[NH:22][C:19]2=[C:15]1[C:12]#[N:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-23996
metacycM:CPD-23996
CHEBI:158799
chebi:158799
AEVYTKKOGUOZJH-UHFFFAOYSA-N
3-methyl-1-oxo-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,5-dihydrobenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile