Vitas-M small molecule compound
1-(5-{[2-(butan-2-yl)phenoxy]methyl}-1,3,4-thiadiazol-2-yl)-3-(4-methylphenyl)urea
Catalog ID
STK057915
SMILES CCC(c1ccccc1OCc1nnc(s1)NC(=O)Nc1ccc(cc1)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 C21H24N4O2S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S/c1-4-15(3)17-7-5-6-8-18(17)27-13-19-24-25-21(28-19)23-20(26)22-16-11-9-14(2)10-12-16/h5-12,15H,4,13H2,1-3H3,(H2,22,23,25,26)InChIKey
FAMXEIVPGFNKQH-UHFFFAOYSA-NSynonyms
426251-37-81((2Z)5((2(BUTAN2YL)PHENOXY)METHYL)134THIADIAZOL2(3H)YLIDENE)3(4METHYLPHENYL)UREA
1(5((2((2S)BUTAN2YL)PHENOXY)METHYL)134THIADIAZOL2YL)3(4METHYLPHENYL)UREA
1(5((2(BUTAN2YL)PHENOXY)METHYL)134THIADIAZOL2YL)3(4METHYLPHENYL)UREA
1(5((2(secbutyl)phenoxy)methyl)134thiadiazol2yl)3(ptolyl)urea
1(5((2BUTAN2YLPHENOXY)METHYL)134THIADIAZOL2YL)3(4METHYLPHENYL)UREA
CCC(C)C1=CC=CC=C1OCC2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)C
CCC(c1ccccc1OCc1nnc(s1)NC(=O)Nc1ccc(cc1)C)C
InChI=1SC21H24N4O2Sc1415(3)17756818(17)271319242521(2819)2320(26)221611914(2)101216h51215H413H213H3(H222232526)
MFCD02638060
STK057915
ZINC000008771011
ZINC000008771015
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.