Vitas-M small molecule compound
1-[1-(4-bromobenzyl)-1H-pyrazol-4-yl]-3-(4-methyl-2-oxo-2H-chromen-7-yl)thiourea
Catalog ID
STK421320
SMILES S=C(Nc1ccc2c(c1)oc(=O)cc2C)Nc1cnn(c1)Cc1ccc(cc1)Br
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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 C21H17BrN4O2S MW 469.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN4O2S/c1-13-8-20(27)28-19-9-16(6-7-18(13)19)24-21(29)25-17-10-23-26(12-17)11-14-2-4-15(22)5-3-14/h2-10,12H,11H2,1H3,(H2,24,25,29)InChIKey
PRERSHVLDYTBIG-UHFFFAOYSA-NSynonyms
1(1((4BROMOPHENYL)METHYL)PYRAZOL4YL)3(4METHYL2OXOCHROMEN7YL)THIOUREA
1(1(4bromobenzyl)1Hpyrazol4yl)3(4methyl2oxo2Hchromen7yl)thiourea
CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=CN(N=C3)CC4=CC=C(C=C4)Br
InChI=1SC21H17BrN4O2Sc113820(27)2819916(6718(13)19)2421(29)2517102326(1217)11142415(22)5314h21012H11H21H3(H2242529)
MFCD04136908
ZINC000002809055
ZINC02809055
ZINC2809055
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