Vitas-M small molecule compound
N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
Catalog ID
STL401342
SMILES Cc1cc(ccc1Cl)Oc1cc(cc(c1)[N+](=O)[O-])NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1
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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 C27H18ClF2N5O4 MW 549.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClF2N5O4/c1-15-9-19(7-8-22(15)28)39-20-11-17(10-18(12-20)35(37)38)32-27(36)21-14-31-34-24(25(29)30)13-23(33-26(21)34)16-5-3-2-4-6-16/h2-14,25H,1H3,(H,32,36)InChIKey
ATTJDNVMPIKGJM-UHFFFAOYSA-NSynonyms
445245-45-4445245454
CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)(N+)(=O)(O))NC(=O)C3=C4N=C(C=C(N4N=C3)C(F)F)C5=CC=CC=C5)Cl
Cc1cc(ccc1Cl)Oc1cc(cc(c1)(N+)(=O)(O))NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1
InChI=1SC27H18ClF2N5O4c115919(7822(15)28)39201117(1018(1220)35(37)38)3227(36)2114313424(25(29)30)1323(3326(21)34)165324616h21425H1H3(H3236)
MFCD02243959
N(3(4chloro3methylphenoxy)5nitrophenyl)7(difluoromethyl)5phenylpyrazolo(15a)pyrimidine3carboxamide
ZINC000002110286
ZINC02110286
ZINC2110286
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