Vitas-M small molecule compound
4-[({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}carbamothioyl)amino]-N-(pyrimidin-2-yl)benzenesulfonamide
Catalog ID
STK466764
SMILES CCC(c1cc(ccc1OCCCCNC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1)C(CC)(C)C)(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 C31H43N5O3S2 MW 597.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H43N5O3S2/c1-7-30(3,4)23-12-17-27(26(22-23)31(5,6)8-2)39-21-10-9-18-34-29(40)35-24-13-15-25(16-14-24)41(37,38)36-28-32-19-11-20-33-28/h11-17,19-20,22H,7-10,18,21H2,1-6H3,(H,32,33,36)(H2,34,35,40)InChIKey
JAMOCFCRYZBLOX-UHFFFAOYSA-NSynonyms
1(4(24bis(2methylbutan2yl)phenoxy)butyl)3(4(pyrimidin2ylsulfamoyl)phenyl)thiourea
4(((4(24bis(2methylbutan2yl)phenoxy)butyl)carbamothioyl)amino)N(pyrimidin2yl)benzenesulfonamide
CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)C(C)(C)CC
InChI=1SC31H43N5O3S2c1730(34)23121727(26(2223)31(56)82)3921109183429(40)3524131525(161424)41(3738)3628321911203328h1117192022H7101821H216H3(H323336)(H2343540)
MFCD06040458
ZINC000097948716
ZINC97948716
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