Vitas-M small molecule compound

2-amino-N-(4-fluorobenzyl)-1-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK714496
SMILES Fc1ccc(cc1)CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)C(C)C

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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 C28H25FN6O MW 480.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25FN6O/c1-17(2)20-11-7-19(8-12-20)16-32-35-26(30)24(28(36)31-15-18-9-13-21(29)14-10-18)25-27(35)34-23-6-4-3-5-22(23)33-25/h3-14,16-17H,15,30H2,1-2H3,(H,31,36)/b32-16+
InChIKey
VVXALKLYEFLSRZ-KPGMTVGESA-N
Synonyms
839703-09-2
(E)2aminoN(4fluorobenzyl)1((4isopropylbenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINON((4FLUOROPHENYL)METHYL)1((E)(4PROPAN2YLPHENYL)METHYLIDENEAMINO)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2aminoN(4fluorobenzyl)1(((E)(4(propan2yl)phenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
839703092
CC(C)C1=CC=C(C=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=C(C=C5)F)N
Fc1ccc(cc1)CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)C(C)C
InChI=1SC28H25FN6Oc117(2)2011719(81220)16323526(30)24(28(36)31151891321(29)141018)2527(35)3423643522(23)3325h3141617H1530H212H3(H3136)b3216+
MFCD03693330
ZINC000002255394
ZINC2255393

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Available files

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