Vitas-M small molecule compound
2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[1-(3-methoxyphenyl)ethyl]benzamide
Catalog ID
STL390435
SMILES COc1cccc(c1)C(NC(=O)c1ccccc1Cn1nc(c(c1C)[N+](=O)[O-])C)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 C22H24N4O4 MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O4/c1-14(17-9-7-10-19(12-17)30-4)23-22(27)20-11-6-5-8-18(20)13-25-16(3)21(26(28)29)15(2)24-25/h5-12,14H,13H2,1-4H3,(H,23,27)InChIKey
ZLINWRQYGJUOBK-UHFFFAOYSA-NSynonyms
1005586-82-21005586822
2((35dimethyl4nitro1Hpyrazol1yl)methyl)N(1(3methoxyphenyl)ethyl)benzamide
2((35DIMETHYL4NITROPYRAZOL1YL)METHYL)N(1(3METHOXYPHENYL)ETHYL)BENZAMIDE
CC1=C(C(=NN1CC2=CC=CC=C2C(=O)NC(C)C3=CC(=CC=C3)OC)C)(N+)(=O)(O)
COc1cccc(c1)C(NC(=O)c1ccccc1Cn1nc(c(c1C)(N+)(=O)(O))C)C
InChI=1SC22H24N4O4c114(17971019(1217)304)2322(27)201165818(20)132516(3)21(26(28)29)15(2)2425h51214H13H214H3(H2327)
MFCD04132133
ZINC000002796479
ZINC000002796480
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