Vitas-M small molecule compound
(5E)-5-{[3-(4-bromophenyl)-1H-pyrazol-4-yl]methylidene}-3-butyl-2-thioxoimidazolidin-4-one
Catalog ID
STL390835
SMILES CCCCN1C(=S)N/C(=C/c2c[nH]nc2c2ccc(cc2)Br)/C1=O
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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 C17H17BrN4OS MW 405.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrN4OS/c1-2-3-8-22-16(23)14(20-17(22)24)9-12-10-19-21-15(12)11-4-6-13(18)7-5-11/h4-7,9-10H,2-3,8H2,1H3,(H,19,21)(H,20,24)/b14-9+InChIKey
YYHOXNABLNMJLK-NTEUORMPSA-NSynonyms
1005553-85-4(5E)5((3(4bromophenyl)1Hpyrazol4yl)methylidene)3butyl2thioxoimidazolidin4one
(5E)5((5(4bromophenyl)1Hpyrazol4yl)methylidene)3butyl2sulfanylideneimidazolidin4one
1005553854
CCCCN1C(=O)C(=CC2=C(NN=C2)C3=CC=C(C=C3)Br)NC1=S
CCCCN1C(=S)NC(=Cc2c(nH)nc2c2ccc(cc2)Br)C1=O
InChI=1SC17H17BrN4OSc12382216(23)14(2017(22)24)91210192115(12)114613(18)7511h47910H238H21H3(H1921)(H2024)b149+
MFCD04051478
ZINC000006399059
ZINC06399059
ZINC6399059
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