Vitas-M small molecule compound
1-[(2E)-5-cyclopentyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-ethoxyphenyl)urea
Catalog ID
STL046928
SMILES CCOc1ccc(cc1)NC(=O)/N=c/1\[nH]nc(s1)C1CCCC1
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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 C16H20N4O2S MW 332.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O2S/c1-2-22-13-9-7-12(8-10-13)17-15(21)18-16-20-19-14(23-16)11-5-3-4-6-11/h7-11H,2-6H2,1H3,(H2,17,18,20,21)InChIKey
QPWGVNMHJKKVLL-UHFFFAOYSA-NSynonyms
426242-80-01((2E)5cyclopentyl134thiadiazol2(3H)ylidene)3(4ethoxyphenyl)urea
1(5CYCLOPENTYL134THIADIAZOL2YL)3(4ETHOXYPHENYL)UREA
426242800
CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)C3CCCC3
CCOc1ccc(cc1)NC(=O)N=c1(nH)nc(s1)C1CCCC1
InChI=1SC16H20N4O2Sc1222139712(81013)1715(21)1816201914(2316)11534611h711H26H21H3(H217182021)
MFCD03799872
ZINC000001301858
ZINC01301858
ZINC1301858
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