Vitas-M small molecule compound

N-(2-{2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl}-1-methyl-1H-benzimidazol-5-yl)-2-(4-nitrophenoxy)acetamide

Catalog ID
STK796459
SMILES O=C(Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccc(cc1)F)COc1ccc(cc1)[N+](=O)[O-]

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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 C28H29FN6O4 MW 532.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29FN6O4/c1-32-26-11-4-21(30-28(36)19-39-24-9-7-23(8-10-24)35(37)38)18-25(26)31-27(32)12-13-33-14-16-34(17-15-33)22-5-2-20(29)3-6-22/h2-11,18H,12-17,19H2,1H3,(H,30,36)
InChIKey
MWEMXIOWGUMQQR-UHFFFAOYSA-N
Synonyms
896813-77-7
896813777
CN1C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)(N+)(=O)(O))N=C1CCN4CCN(CC4)C5=CC=C(C=C5)F
InChI=1SC28H29FN6O4c1322611421(3028(36)1939249723(81024)35(37)38)1825(26)3127(32)121333141634(171533)225220(29)3622h21118H121719H21H3(H3036)
MFCD06596766
N(2(2(4(4fluorophenyl)piperazin1yl)ethyl)1methyl1Hbenzimidazol5yl)2(4nitrophenoxy)acetamide
N(2(2(4(4fluorophenyl)piperazin1yl)ethyl)1methyl1Hbenzo(d)imidazol5yl)2(4nitrophenoxy)acetamide
N(2(2(4(4FLUOROPHENYL)PIPERAZIN1YL)ETHYL)1METHYLBENZIMIDAZOL5YL)2(4NITROPHENOXY)ACETAMIDE
O=C(Nc1ccc2c(c1)nc(n2C)CCN1CCN(CC1)c1ccc(cc1)F)COc1ccc(cc1)(N+)(=O)(O)
ZINC000097955866
ZINC97955866

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Available files

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