Vitas-M small molecule compound
3-[3-({4-[3-(morpholin-4-yl)-4-nitrophenyl]piperazin-1-yl}carbonyl)phenyl]-2H-chromen-2-one
Catalog ID
STK346241
SMILES O=C(c1cccc(c1)c1cc2ccccc2oc1=O)N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)[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 C30H28N4O6 MW 540.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O6/c35-29(23-6-3-5-21(18-23)25-19-22-4-1-2-7-28(22)40-30(25)36)33-12-10-31(11-13-33)24-8-9-26(34(37)38)27(20-24)32-14-16-39-17-15-32/h1-9,18-20H,10-17H2InChIKey
CPEPSYXJXYWFOY-UHFFFAOYSA-NSynonyms
3(3((4(3(morpholin4yl)4nitrophenyl)piperazin1yl)carbonyl)phenyl)2Hchromen2one
3(3(4(3MORPHOLIN4YL4NITROPHENYL)PIPERAZINE1CARBONYL)PHENYL)CHROMEN2ONE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))N3CCOCC3)C(=O)C4=CC=CC(=C4)C5=CC6=CC=CC=C6OC5=O
InChI=1SC30H28N4O6c3529(2363521(1823)251922412728(22)4030(25)36)33121031(111333)248926(34(37)38)27(2024)32141639171532h191820H1017H2
MFCD05829466
O=C(c1cccc(c1)c1cc2ccccc2oc1=O)N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)(N+)(=O)(O)
ZINC000059612697
ZINC59612697
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