Vitas-M small molecule compound
1-(4-chlorophenyl)-3-[(2E)-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Catalog ID
STK559672
SMILES Clc1ccc(cc1)NC(=O)/N=c/1\[nH]nc(s1)C12CC3CC(C2)CC(C1)C3
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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 C19H21ClN4OS MW 388.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN4OS/c20-14-1-3-15(4-2-14)21-17(25)22-18-24-23-16(26-18)19-8-11-5-12(9-19)7-13(6-11)10-19/h1-4,11-13H,5-10H2,(H2,21,22,24,25)InChIKey
QUQRQYOXKQGJDD-UHFFFAOYSA-NSynonyms
6074-96-01(4chlorophenyl)3((2E)5(tricyclo(3311~37~)dec1yl)134thiadiazol2(3H)ylidene)urea
1(5(1ADAMANTYL)134THIADIAZOL2YL)3(4CHLOROPHENYL)UREA
6074960
C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)NC5=CC=C(C=C5)Cl
Clc1ccc(cc1)NC(=O)N=c1(nH)nc(s1)C12CC3CC(C2)CC(C1)C3
InChI=1SC19H21ClN4OSc20141315(4214)2117(25)2218242316(2618)19811512(919)713(611)1019h141113H510H2(H221222425)
MFCD03799683
ZINC000004899228
ZINC04899228
ZINC4899228
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