Vitas-M small molecule compound
N-{[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide
Catalog ID
STK234497
SMILES O=C(CC12CC3CC(C2)CC(C1)C3)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccc(cc1)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 C27H29N3O2S MW 459.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2S/c1-16-2-4-20(5-3-16)25-29-22-11-21(6-7-23(22)32-25)28-26(33)30-24(31)15-27-12-17-8-18(13-27)10-19(9-17)14-27/h2-7,11,17-19H,8-10,12-15H2,1H3,(H2,28,30,31,33)InChIKey
HMXAFJZRIANVNF-UHFFFAOYSA-NSynonyms
2(1ADAMANTYL)N((2(4METHYLPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)ACETAMIDE
CC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)CC45CC6CC(C4)CC(C6)C5
InChI=1SC27H29N3O2Sc1162420(5316)2529221121(6723(22)3225)2826(33)3024(31)15271217818(1327)1019(917)1427h27111719H8101215H21H3(H228303133)
MFCD03906805
N((2(4methylphenyl)13benzoxazol5yl)carbamothioyl)2(tricyclo(3311~37~)dec1yl)acetamide
ZINC000009189837
ZINC09189837
ZINC9189837
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