Vitas-M small molecule compound
N-{[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]carbamothioyl}-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide
Catalog ID
STK243952
SMILES COc1ccc(cc1NC(=S)NC(=O)CC12CC3CC(C2)CC(C1)C3)c1nc2c(s1)cccc2
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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 C27H29N3O2S2 MW 491.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2S2/c1-32-22-7-6-19(25-28-20-4-2-3-5-23(20)34-25)11-21(22)29-26(33)30-24(31)15-27-12-16-8-17(13-27)10-18(9-16)14-27/h2-7,11,16-18H,8-10,12-15H2,1H3,(H2,29,30,31,33)InChIKey
FTLYVEBZHSQQPU-UHFFFAOYSA-NSynonyms
2(1ADAMANTYL)N((5(13BENZOTHIAZOL2YL)2METHOXYPHENYL)CARBAMOTHIOYL)ACETAMIDE
COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)CC45CC6CC(C4)CC(C6)C5
InChI=1SC27H29N3O2S2c132227619(252820423523(20)3425)1121(22)2926(33)3024(31)15271216817(1327)1018(916)1427h27111618H8101215H21H3(H229303133)
MFCD03922590
N((5(13benzothiazol2yl)2methoxyphenyl)carbamothioyl)2(tricyclo(3311~37~)dec1yl)acetamide
ZINC000006297341
ZINC06297341
ZINC6297341
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