Vitas-M small molecule compound
3-(4-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonyl}phenyl)-2H-chromen-2-one
Catalog ID
STK206473
SMILES O=C(c1ccc(cc1)c1cc2ccccc2oc1=O)N1CCN(CC1)c1ccc(cc1Cl)[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 C26H20ClN3O5 MW 489.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN3O5/c27-22-16-20(30(33)34)9-10-23(22)28-11-13-29(14-12-28)25(31)18-7-5-17(6-8-18)21-15-19-3-1-2-4-24(19)35-26(21)32/h1-10,15-16H,11-14H2InChIKey
WVLMXBXUBXRQIE-UHFFFAOYSA-NSynonyms
847338-70-93(4((4(2CHLORO4NITROPHENYL)PIPERAZIN1YL)CARBONYL)PHENYL)2HCHROMEN2ONE
3(4(4(2chloro4nitrophenyl)piperazine1carbonyl)phenyl)2Hchromen2one
3(4(4(2CHLORO4NITROPHENYL)PIPERAZINE1CARBONYL)PHENYL)CHROMEN2ONE
847338709
C1CN(CCN1C2=C(C=C(C=C2)(N+)(=O)(O))Cl)C(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O
InChI=1SC26H20ClN3O5c27221620(30(33)34)91023(22)28111329(141228)25(31)187517(6818)211519312424(19)3526(21)32h1101516H1114H2
MFCD04180031
O=C(c1ccc(cc1)c1cc2ccccc2oc1=O)N1CCN(CC1)c1ccc(cc1Cl)(N+)(=O)(O)
ZINC000009013887
ZINC09013887
ZINC9013887
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