Vitas-M small molecule compound

ethyl [(3Z)-2-oxo-3-{2-[({[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]carbonyl}amino)acetyl]hydrazinylidene}-2,3-dihydro-1H-indol-1-yl]acetate

Catalog ID
STK708131
SMILES CCOC(=O)CN1C(=O)/C(=N\NC(=O)CNC(=O)n2c(nc3c2cccc3)c2ccccn2)/c2c1cccc2

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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 C27H23N7O5 MW 525.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N7O5/c1-2-39-23(36)16-33-20-12-5-3-9-17(20)24(26(33)37)32-31-22(35)15-29-27(38)34-21-13-6-4-10-18(21)30-25(34)19-11-7-8-14-28-19/h3-14H,2,15-16H2,1H3,(H,29,38)(H,31,35)/b32-24-
InChIKey
GTJXACQDPZCOCW-TZHWMEPESA-N
Synonyms

CCOC(=O)CN1C(=O)C(=NNC(=O)CNC(=O)n2c(nc3c2cccc3)c2ccccn2)c2c1cccc2
CCOC(=O)CN1C2=CC=CC=C2C(=NNC(=O)CNC(=O)N3C4=CC=CC=C4N=C3C5=CC=CC=N5)C1=O
ethyl((3Z)2oxo3(2((((2(pyridin2yl)1Hbenzimidazol1yl)carbonyl)amino)acetyl)hydrazinylidene)23dihydro1Hindol1yl)acetate
ETHYL2((3Z)2OXO3((2((2PYRIDIN2YLBENZIMIDAZOLE1CARBONYL)AMINO)ACETYL)HYDRAZINYLIDENE)INDOL1YL)ACETATE
ethyl2(2oxo3(2(2(2(pyridin2yl)1Hbenzo(d)imidazole1carboxamido)acetyl)hydrazono)indolin1yl)acetate
InChI=1SC27H23N7O5c123923(36)1633201253917(20)24(26(33)37)323122(35)152927(38)342113641018(21)3025(34)191178142819h314H21516H21H3(H2938)(H3135)b3224
MFCD01945196
ZINC000050860213
ZINC100218800

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.