Vitas-M small molecule compound
3-[3-({4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}carbonyl)phenyl]-2H-chromen-2-one
Catalog ID
STK347247
SMILES O=C(c1cccc(c1)c1cc2ccccc2oc1=O)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)[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 C31H30N4O5 MW 538.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O5/c36-30(24-9-6-8-22(19-24)26-20-23-7-2-3-10-29(23)40-31(26)37)34-17-15-32(16-18-34)25-11-12-27(35(38)39)28(21-25)33-13-4-1-5-14-33/h2-3,6-12,19-21H,1,4-5,13-18H2InChIKey
HPFDBRQEZHPSSR-UHFFFAOYSA-NSynonyms
3(3((4(4nitro3(piperidin1yl)phenyl)piperazin1yl)carbonyl)phenyl)2Hchromen2one
3(3(4(4NITRO3PIPERIDIN1YLPHENYL)PIPERAZINE1CARBONYL)PHENYL)CHROMEN2ONE
C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC=CC(=C4)C5=CC6=CC=CC=C6OC5=O)(N+)(=O)(O)
InChI=1SC31H30N4O5c3630(2496822(1924)2620237231029(23)4031(26)37)34171532(161834)25111227(35(38)39)28(2125)33134151433h236121921H1451318H2
MFCD05829547
O=C(c1cccc(c1)c1cc2ccccc2oc1=O)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)(N+)(=O)(O)
ZINC000059617026
ZINC59617026
Check stock
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