Vitas-M small molecule compound
2-amino-1-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-N-(4-fluorobenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK714495
SMILES COc1cccc(c1OC)/C=N/n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc(cc1)F
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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 C27H23FN6O3 MW 498.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN6O3/c1-36-21-9-5-6-17(24(21)37-2)15-31-34-25(29)22(27(35)30-14-16-10-12-18(28)13-11-16)23-26(34)33-20-8-4-3-7-19(20)32-23/h3-13,15H,14,29H2,1-2H3,(H,30,35)/b31-15+InChIKey
MTMHOHIRJIYUIX-IBBHUPRXSA-NSynonyms
836629-69-7(E)2amino1((23dimethoxybenzylidene)amino)N(4fluorobenzyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(23dimethoxyphenyl)methylidene)amino)N(4fluorobenzyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(23DIMETHOXYPHENYL)METHYLIDENEAMINO)N((4FLUOROPHENYL)METHYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
836629697
COC1=CC=CC(=C1OC)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=C(C=C5)F)N
COc1cccc(c1OC)C=Nn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc(cc1)F
InChI=1SC27H23FN6O3c1362195617(24(21)372)15313425(29)22(27(35)301416101218(28)131116)2326(34)3320843719(20)3223h31315H1429H212H3(H3035)b3115+
MFCD03688524
ZINC000002250875
ZINC2250874
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