Vitas-M small molecule compound
5-(4-chlorophenyl)-N-{3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl}-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Catalog ID
STK676223
SMILES Clc1ccc(cc1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)Nc1cc(Oc2cccc(c2)C(F)(F)F)cc(c1)[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 C27H14ClF6N5O4 MW 621.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H14ClF6N5O4/c28-16-6-4-14(5-7-16)21-12-23(27(32,33)34)38-24(36-21)13-22(37-38)25(40)35-17-9-18(39(41)42)11-20(10-17)43-19-3-1-2-15(8-19)26(29,30)31/h1-13H,(H,35,40)InChIKey
LFBPLLNEBNRHFM-UHFFFAOYSA-NSynonyms
5(4chlorophenyl)N(3nitro5(3(trifluoromethyl)phenoxy)phenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamide
C1=CC(=CC(=C1)OC2=CC(=CC(=C2)(N+)(=O)(O))NC(=O)C3=NN4C(=CC(=NC4=C3)C5=CC=C(C=C5)Cl)C(F)(F)F)C(F)(F)F
Clc1ccc(cc1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)Nc1cc(Oc2cccc(c2)C(F)(F)F)cc(c1)(N+)(=O)(O)
InChI=1SC27H14ClF6N5O4c28166414(5716)211223(27(3233)34)3824(3621)1322(3738)25(40)3517918(39(41)42)1120(1017)431931215(819)26(2930)31h113H(H3540)
MFCD01529570
ZINC000150368925
ZINC150368925
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