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IN-NXX70

PropertiesImage
MNX_IDMNXM527379 Image of MNXM527379
referenceenvipathM:...015c54ebb136
formulaC19H13BrN6O2
global charge0
mol weight437.257
InChIKeyMRPDCVCSEIWJMW-UHFFFAOYSA-N
InChIInChI=1S/C19H13BrN6O2/c1-10-6-11(9-21)7-12-16(10)23-17(25(2)19(12)28)13-8-15(20)24-26(13)18-14(27)4-3-5-22-18/h3-8,27H,1-2H3
SMILESCC1=CC(C#N)=CC2=C1N=C(C1=CC(Br)=NN1C1=NC=CC=C1O)N(C)C2=O
MNX internals
InChI (mnx)InChI=1/C19H13BrN6O2/c1-10-6-11(9-21)7-12-16(10)23-17(25(2)19(12)28)13-8-15(20)24-26(13)18-14(27)4-3-5-22-18/h3-8,27H,1-2H3 Image of MNXM527379
SMILES (mnx)[CH3:1][C:10]1=[CH:6][C:11]([C:9]#[N:21])=[CH:7][C:12]2=[C:16]1[N:23]=[C:17]([C:13]1=[CH:8][C:15]([Br:20])=[N:24][N:26]1[C:18]1=[C:14]([OH:27])[CH:4]=[CH:3][CH:5]=[N:22]1)[N:25]([CH3:2])[C:19]2=[O:28]
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

envipath:...66ec207daed3
envipathM:...66ec207daed3
envipath:...015c54ebb136
envipathM:...015c54ebb136
MRPDCVCSEIWJMW-UHFFFAOYSA-N 		IN-NXX70

envipath:...0677a6fc454d
envipathM:...0677a6fc454d
MRPDCVCSEIWJMW-UHFFFAOYSA-N 		compound 0284794