Vitas-M small molecule compound
4-[({4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)amino]-N-(1,5-dimethyl-1H-pyrazol-4-yl)-1-methyl-1H-pyrazole-5-carboxamide
Catalog ID
STK311447
SMILES O=C(c1ccc(cc1)Cn1cc(c(n1)[N+](=O)[O-])Cl)Nc1cnn(c1C(=O)Nc1cnn(c1C)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 C21H20ClN9O4 MW 497.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN9O4/c1-12-16(8-23-28(12)2)25-21(33)18-17(9-24-29(18)3)26-20(32)14-6-4-13(5-7-14)10-30-11-15(22)19(27-30)31(34)35/h4-9,11H,10H2,1-3H3,(H,25,33)(H,26,32)InChIKey
IPWKFSIMYFNENO-UHFFFAOYSA-NSynonyms
1005571-52-71005571527
4(((4((4chloro3nitro1Hpyrazol1yl)methyl)phenyl)carbonyl)amino)N(15dimethyl1Hpyrazol4yl)1methyl1Hpyrazole5carboxamide
4((4((4chloro3nitropyrazol1yl)methyl)benzoyl)amino)N(15dimethylpyrazol4yl)2methylpyrazole3carboxamide
CC1=C(C=NN1C)NC(=O)C2=C(C=NN2C)NC(=O)C3=CC=C(C=C3)CN4C=C(C(=N4)(N+)(=O)(O))Cl
InChI=1SC21H20ClN9O4c11216(82328(12)2)2521(33)1817(92429(18)3)2620(32)146413(5714)10301115(22)19(2730)31(34)35h4911H10H213H3(H2533)(H2632)
MFCD04137916
O=C(c1ccc(cc1)Cn1cc(c(n1)(N+)(=O)(O))Cl)Nc1cnn(c1C(=O)Nc1cnn(c1C)C)C
ZINC000002809406
ZINC02809406
ZINC2809406
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