Vitas-M small molecule compound
8-fluoro-3-({(E)-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methylidene}amino)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Catalog ID
STK530760
SMILES COc1ccc(cc1CN1CCOCC1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(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 C23H22FN5O4 MW 451.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN5O4/c1-32-19-5-2-14(10-15(19)13-28-6-8-33-9-7-28)12-25-29-22(30)21-20(27-23(29)31)17-11-16(24)3-4-18(17)26-21/h2-5,10-12,26H,6-9,13H2,1H3,(H,27,31)/b25-12+InChIKey
MJGKANARINYBIF-BRJLIKDPSA-NSynonyms
(E)8fluoro3((4methoxy3(morpholinomethyl)benzylidene)amino)1Hpyrimido(54b)indole24(3H5H)dione
8fluoro3(((E)(4methoxy3(morpholin4ylmethyl)phenyl)methylidene)amino)1Hpyrimido(54b)indole24(3H5H)dione
8FLUORO3((E)(4METHOXY3(MORPHOLIN4YLMETHYL)PHENYL)METHYLIDENEAMINO)15DIHYDROPYRIMIDO(54B)INDOLE24DIONE
COC1=C(C=C(C=C1)C=NN2C(=O)C3=C(C4=C(N3)C=CC(=C4)F)NC2=O)CN5CCOCC5
COc1ccc(cc1CN1CCOCC1)C=Nn1c(=O)(nH)c2c(c1=O)(nH)c1c2cc(cc1)F
InChI=1SC23H22FN5O4c132195214(1015(19)132868339728)12252922(30)2120(2723(29)31)171116(24)3418(17)2621h25101226H6913H21H3(H2731)b2512+
MFCD02239473
ZINC000002297012
ZINC2297011
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