Vitas-M small molecule compound
2-(2-methoxy-5-{(E)-[(4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)imino]methyl}benzyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STL327501
SMILES COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
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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 C27H19N5O4 MW 477.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N5O4/c1-36-22-11-10-16(12-17(22)14-31-25(33)18-6-2-3-7-19(18)26(31)34)13-29-32-15-28-23-20-8-4-5-9-21(20)30-24(23)27(32)35/h2-13,15,30H,14H2,1H3/b29-13+InChIKey
POSRVKCGIJYYKK-VFLNYLIXSA-NSynonyms
373375-75-8(E)2(2methoxy5(((4oxo45dihydro3Hpyrimido(54b)indol3yl)imino)methyl)benzyl)isoindoline13dione
2((2METHOXY5((E)(4OXO5HPYRIMIDO(54B)INDOL3YL)IMINOMETHYL)PHENYL)METHYL)ISOINDOLE13DIONE
2(2methoxy5((E)((4oxo45dihydro3Hpyrimido(54b)indol3yl)imino)methyl)benzyl)1Hisoindole13(2H)dione
373375758
COC1=C(C=C(C=C1)C=NN2C=NC3=C(C2=O)NC4=CC=CC=C43)CN5C(=O)C6=CC=CC=C6C5=O
COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)C=Nn1cnc2c(c1=O)(nH)c1c2cccc1
InChI=1SC27H19N5O4c13622111016(1217(22)143125(33)18623719(18)26(31)34)13293215282320845921(20)3024(23)27(32)35h2131530H14H21H3b2913+
MFCD01947232
ZINC000002280685
ZINC2280684
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