Vitas-M small molecule compound
1,1'-[methanediylbis(1H-pyrazole-1,4-diyl)]bis{3-[2-(3,4-diethoxyphenyl)ethyl](thiourea)}
Catalog ID
STK309081
SMILES CCOc1cc(CCNC(=S)Nc2cnn(c2)Cn2ncc(c2)NC(=S)NCCc2ccc(c(c2)OCC)OCC)ccc1OCC
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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 C33H44N8O4S2 MW 680.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H44N8O4S2/c1-5-42-28-11-9-24(17-30(28)44-7-3)13-15-34-32(46)38-26-19-36-40(21-26)23-41-22-27(20-37-41)39-33(47)35-16-14-25-10-12-29(43-6-2)31(18-25)45-8-4/h9-12,17-22H,5-8,13-16,23H2,1-4H3,(H2,34,38,46)(H2,35,39,47)InChIKey
LZQWTHVRKVSYJZ-UHFFFAOYSA-NSynonyms
1005690-31-21(2(34diethoxyphenyl)ethyl)3(1((4(2(34diethoxyphenyl)ethylcarbamothioylamino)pyrazol1yl)methyl)pyrazol4yl)thiourea
1005690312
11(methanediylbis(1Hpyrazole14diyl))bis(3(2(34diethoxyphenyl)ethyl)(thiourea))
CCOC1=C(C=C(C=C1)CCNC(=S)NC2=CN(N=C2)CN3C=C(C=N3)NC(=S)NCCC4=CC(=C(C=C4)OCC)OCC)OCC
InChI=1SC33H44N8O4S2c15422811924(1730(28)4473)13153432(46)3826193640(2126)23412227(203741)3933(47)35161425101229(4362)31(1825)4584h9121722H58131623H214H3(H2343846)(H2353947)
MFCD04133463
ZINC000097949235
ZINC97949235
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