Vitas-M small molecule compound
3-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]carbonyl}-8-methoxy-2H-chromen-2-one
Catalog ID
STK422901
SMILES COc1cccc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)c1cc(Cl)ccc1C
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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 C22H21ClN2O4 MW 412.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O4/c1-14-6-7-16(23)13-18(14)24-8-10-25(11-9-24)21(26)17-12-15-4-3-5-19(28-2)20(15)29-22(17)27/h3-7,12-13H,8-11H2,1-2H3InChIKey
SCJJCGHERITTKJ-UHFFFAOYSA-NSynonyms
3((4(5chloro2methylphenyl)piperazin1yl)carbonyl)8methoxy2Hchromen2one
3((4(5CHLORO2METHYLPHENYL)PIPERAZINYL)CARBONYL)8METHOXYCHROMEN2ONE
3(4(5CHLORO2METHYLPHENYL)PIPERAZINE1CARBONYL)8METHOXYCHROMEN2ONE
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC4=C(C(=CC=C4)OC)OC3=O
InChI=1SC22H21ClN2O4c1146716(23)1318(14)2481025(11924)21(26)17121543519(282)20(15)2922(17)27h371213H811H212H3
MFCD02177161
ZINC000001456704
ZINC01456704
ZINC1456704
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