Vitas-M small molecule compound
3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-N-[3-(2-methoxyphenoxy)-5-nitrophenyl]propanamide
Catalog ID
STK308248
SMILES COc1ccccc1Oc1cc(NC(=O)CCn2nc(c(c2C)Cl)C)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 C21H21ClN4O5 MW 444.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O5/c1-13-21(22)14(2)25(24-13)9-8-20(27)23-15-10-16(26(28)29)12-17(11-15)31-19-7-5-4-6-18(19)30-3/h4-7,10-12H,8-9H2,1-3H3,(H,23,27)InChIKey
GKXOPFXGNHRKMT-UHFFFAOYSA-NSynonyms
1005684-99-01005684990
3(4chloro35dimethyl1Hpyrazol1yl)N(3(2methoxyphenoxy)5nitrophenyl)propanamide
3(4CHLORO35DIMETHYLPYRAZOL1YL)N(3(2METHOXYPHENOXY)5NITROPHENYL)PROPANAMIDE
CC1=C(C(=NN1CCC(=O)NC2=CC(=CC(=C2)OC3=CC=CC=C3OC)(N+)(=O)(O))C)Cl
COc1ccccc1Oc1cc(NC(=O)CCn2nc(c(c2C)Cl)C)cc(c1)(N+)(=O)(O)
InChI=1SC21H21ClN4O5c11321(22)14(2)25(2413)9820(27)23151016(26(28)29)1217(1115)3119754618(19)303h471012H89H213H3(H2327)
MFCD04131966
ZINC000002796261
ZINC02796261
ZINC2796261
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