Vitas-M small molecule compound
1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-tricyclo[3.3.1.1~3,7~]dec-1-ylurea
Catalog ID
STK038972
SMILES O=C(NC12CC3CC(C2)CC(C1)C3)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)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 C25H27N3OS MW 417.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3OS/c1-15-2-7-21-22(8-15)30-23(27-21)19-3-5-20(6-4-19)26-24(29)28-25-12-16-9-17(13-25)11-18(10-16)14-25/h2-8,16-18H,9-14H2,1H3,(H2,26,28,29)InChIKey
ZSLSMTJGIZYZKI-UHFFFAOYSA-NSynonyms
1(1ADAMANTYL)3(4(6METHYL13BENZOTHIAZOL2YL)PHENYL)UREA
1(4(6methyl13benzothiazol2yl)phenyl)3tricyclo(3311~37~)dec1ylurea
CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)NC45CC6CC(C4)CC(C6)C5
InChI=1SC25H27N3OSc115272122(815)3023(2721)193520(6419)2624(29)28251216917(1325)1118(1016)1425h281618H914H21H3(H2262829)
MFCD06029841
O=C(NC12CC3CC(C2)CC(C1)C3)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C
STK038972
ZINC000004616446
ZINC04616446
ZINC4616446
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