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1-[3-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]-2-pyrrolidinone

PropertiesImage
MNX_IDMNXM340960 Image of MNXM340960
referencechebi:111281
formulaC18H21N5O
global charge0
mol weight323.4
InChIKeyOOVANMUGXMIRNE-UHFFFAOYSA-N
InChIInChI=1S/C18H21N5O/c1-12-5-6-14-13(10-12)16-17(22-14)18(21-11-20-16)19-7-3-9-23-8-2-4-15(23)24/h5-6,10-11,22H,2-4,7-9H2,1H3,(H,19,20,21)
SMILESCC1=CC2=C(C=C1)NC1=C2N=CN=C1NCCCN1CCCC1=O
MNX internals
InChI (mnx)InChI=1/C18H21N5O/c1-12-5-6-14-13(10-12)16-17(22-14)18(21-11-20-16)19-7-3-9-23-8-2-4-15(23)24/h5-6,10-11,22H,2-4,7-9H2,1H3,(H,19,20,21) Image of MNXM340960
SMILES (mnx)[CH3:1][C:12]1=[CH:10][C:13]2=[C:14]([CH:6]=[CH:5]1)[NH:22][C:17]1=[C:16]2[N:20]=[CH:11][NH:21][C:18]1=[N:19][CH2:7][CH2:3][CH2:9][N:23]1[CH2:8][CH2:2][CH2:4][C:15]1=[O:24]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:111281
chebi:111281
OOVANMUGXMIRNE-UHFFFAOYSA-N
1-[3-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)amino]propyl]-2-pyrrolidinone