Vitas-M small molecule compound
N-(3-{(1Z)-1-[2-({5-[(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}carbonyl)hydrazinylidene]ethyl}phenyl)-2-fluorobenzamide
Catalog ID
STK453006
SMILES C/C(=N/NC(=O)c1ccc(o1)Cn1nc(c(c1C)Cl)[N+](=O)[O-])/c1cccc(c1)NC(=O)c1ccccc1F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H20ClFN6O5 MW 538.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClFN6O5/c1-14(16-6-5-7-17(12-16)28-24(34)19-8-3-4-9-20(19)27)29-30-25(35)21-11-10-18(38-21)13-32-15(2)22(26)23(31-32)33(36)37/h3-12H,13H2,1-2H3,(H,28,34)(H,30,35)/b29-14-InChIKey
BBCYBJLUFWZLRN-NUJZUDFISA-NSynonyms
5((4CHLORO5METHYL3NITROPYRAZOL1YL)METHYL)N((Z)1(3((2FLUOROBENZOYL)AMINO)PHENYL)ETHYLIDENEAMINO)FURAN2CARBOXAMIDE
CC(=NNC(=O)c1ccc(o1)Cn1nc(c(c1C)Cl)(N+)(=O)(O))c1cccc(c1)NC(=O)c1ccccc1F
CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NN=C(C)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4F)(N+)(=O)(O))Cl
InChI=1SC25H20ClFN6O5c114(1665717(1216)2824(34)19834920(19)27)293025(35)21111018(3821)133215(2)22(26)23(3132)33(36)37h312H13H212H3(H2834)(H3035)b2914
MFCD02606767
N((1Z)2(3((2FLUOROPHENYL)CARBONYLAMINO)PHENYL)1AZAPROP1ENYL)(5((4CHLORO5METHYL3NITROPYRAZOLYL)METHYL)(2FURYL))CARBOXAMIDE
N(3((1Z)1(2((5((4chloro5methyl3nitro1Hpyrazol1yl)methyl)furan2yl)carbonyl)hydrazinylidene)ethyl)phenyl)2fluorobenzamide
N(3(N(5((4CHLORO3NITRO5METHYL1HPYRAZOL1YL)METHYL)2FUROYL)ETHANEHYDRAZONOYL)PHENYL)2FLUOROBENZAMIDE
ZINC000101156034
ZINC673024
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