Vitas-M small molecule compound
N-[3-(4-chlorophenoxy)-5-nitrophenyl]-1-ethyl-3,5-dimethyl-1H-pyrazole-4-carboxamide
Catalog ID
STL400427
SMILES CCn1nc(c(c1C)C(=O)Nc1cc(Oc2ccc(cc2)Cl)cc(c1)[N+](=O)[O-])C
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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 C20H19ClN4O4 MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O4/c1-4-24-13(3)19(12(2)23-24)20(26)22-15-9-16(25(27)28)11-18(10-15)29-17-7-5-14(21)6-8-17/h5-11H,4H2,1-3H3,(H,22,26)InChIKey
PXDYSXUCEVHHKC-UHFFFAOYSA-NSynonyms
957511-07-8957511078
CCN1C(=C(C(=N1)C)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)(N+)(=O)(O))C
CCn1nc(c(c1C)C(=O)Nc1cc(Oc2ccc(cc2)Cl)cc(c1)(N+)(=O)(O))C
InChI=1SC20H19ClN4O4c142413(3)19(12(2)2324)20(26)2215916(25(27)28)1118(1015)29177514(21)6817h511H4H213H3(H2226)
MFCD04048183
N(3(4CHLORANYLPHENOXY)5NITROPHENYL)1ETHYL35DIMETHYLPYRAZOLE4CARBOXAMIDE
N(3(4chlorophenoxy)5nitrophenyl)1ethyl35dimethyl1Hpyrazole4carboxamide
N(3(4CHLOROPHENOXY)5NITROPHENYL)1ETHYL35DIMETHYL4PYRAZOLECARBOXAMIDE
N(3(4CHLOROPHENOXY)5NITROPHENYL)1ETHYL35DIMETHYLPYRAZOLE4CARBOXAMIDE
ZINC000000655723
ZINC00655723
ZINC655723
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