Vitas-M small molecule compound
1-[4-chloro-1-(2,4-dichlorobenzyl)-1H-pyrazol-3-yl]-3-(4-methyl-2-oxo-2H-chromen-7-yl)thiourea
Catalog ID
STK311320
SMILES S=C(Nc1nn(cc1Cl)Cc1ccc(cc1Cl)Cl)Nc1ccc2c(c1)oc(=O)cc2C
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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 C21H15Cl3N4O2S MW 493.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl3N4O2S/c1-11-6-19(29)30-18-8-14(4-5-15(11)18)25-21(31)26-20-17(24)10-28(27-20)9-12-2-3-13(22)7-16(12)23/h2-8,10H,9H2,1H3,(H2,25,26,27,31)InChIKey
MXHPTFWNYOFNQL-UHFFFAOYSA-NSynonyms
896200-66-11(4chloro1((24dichlorophenyl)methyl)pyrazol3yl)3(4methyl2oxochromen7yl)thiourea
1(4chloro1(24dichlorobenzyl)1Hpyrazol3yl)3(4methyl2oxo2Hchromen7yl)thiourea
896200661
CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=NN(C=C3Cl)CC4=C(C=C(C=C4)Cl)Cl
InChI=1SC21H15Cl3N4O2Sc111619(29)3018814(4515(11)18)2521(31)262017(24)1028(2720)9122313(22)716(12)23h2810H9H21H3(H225262731)
MFCD04137045
ZINC000002809068
ZINC02809068
ZINC2809068
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