| Properties | Image |
MNX_ID | MNXM160898 |
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reference | chebi:79310 |
formula | C15H13ClN4 |
global charge | 0 |
mol weight | 284.75 |
InChIKey | LFMFPKKYRXFHHZ-UHFFFAOYSA-N |
InChI | InChI=1S/C15H13ClN4/c1-9-6-7-10(8-12(9)16)18-15-19-13-5-3-2-4-11(13)14(17)20-15/h2-8H,1H3,(H3,17,18,19,20) |
SMILES | CC1=C(Cl)C=C(NC2=NC(N)=C3C=CC=CC3=N2)C=C1 |
MNX internals
InChI (mnx) | InChI=1/C15H13ClN4/c1-9-6-7-10(8-12(9)16)18-15-19-13-5-3-2-4-11(13)14(17)20-15/h2-8H,1H3,(H3,17,18,19,20) |
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SMILES (mnx) | [CH3:1][C:9]1=[C:12]([Cl:16])[CH:8]=[C:10]([N:18]=[C:15]2[NH:19][C:13]3=[CH:5][CH:3]=[CH:2][CH:4]=[C:11]3[C:14](=[NH:17])[NH:20]2)[CH:7]=[CH:6]1 |
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