Vitas-M small molecule compound
ethyl 4-{[1-(2,4-difluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]carbonyl}piperazine-1-carboxylate
Catalog ID
STL161083
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1cnn(c1n1cccc1)c1ccc(cc1F)F
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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 C21H21F2N5O3 MW 429.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F2N5O3/c1-2-31-21(30)27-11-9-26(10-12-27)20(29)16-14-24-28(19(16)25-7-3-4-8-25)18-6-5-15(22)13-17(18)23/h3-8,13-14H,2,9-12H2,1H3InChIKey
BWYIITNXTJZGEB-UHFFFAOYSA-NSynonyms
1246047-44-81246047448
CCOC(=O)N1CCN(CC1)C(=O)C2=C(N(N=C2)C3=C(C=C(C=C3)F)F)N4C=CC=C4
ethyl4((1(24difluorophenyl)5(1Hpyrrol1yl)1Hpyrazol4yl)carbonyl)piperazine1carboxylate
ethyl4(1(24difluorophenyl)5(1Hpyrrol1yl)1Hpyrazole4carbonyl)piperazine1carboxylate
ethyl4(1(24difluorophenyl)5pyrrol1ylpyrazole4carbonyl)piperazine1carboxylate
InChI=1SC21H21F2N5O3c123121(30)2711926(101227)20(29)16142428(19(16)25734825)186515(22)1317(18)23h381314H2912H21H3
MFCD18065582
ZINC000022519355
ZINC22519355
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