Vitas-M small molecule compound
N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STK712226
SMILES COc1cc(ccc1OC)Cc1nnc(s1)NC(=O)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 C22H27N3O3S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O3S/c1-27-17-4-3-13(8-18(17)28-2)9-19-24-25-21(29-19)23-20(26)22-10-14-5-15(11-22)7-16(6-14)12-22/h3-4,8,14-16H,5-7,9-12H2,1-2H3,(H,23,25,26)InChIKey
JEGADTQVWKHTNO-UHFFFAOYSA-NSynonyms
328561-21-3(3r5r7r)N(5(34dimethoxybenzyl)134thiadiazol2yl)adamantane1carboxamide
COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)C34CC5CC(C3)CC(C5)C4)OC
COc1cc(ccc1OC)Cc1nnc(s1)NC(=O)C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3
InChI=1SC22H27N3O3Sc127174313(818(17)282)919242521(2919)2320(26)221014515(1122)716(614)1222h3481416H57912H212H3(H232526)
MFCD01929187
N(5((34DIMETHOXYPHENYL)METHYL)134THIADIAZOL2YL)ADAMANTANE1CARBOXAMIDE
N(5(34DIMETHOXYBENZYL)134THIADIAZOL2YL)1ADAMANTANECARBOXAMIDE
N(5(34dimethoxybenzyl)134thiadiazol2yl)tricyclo(3311~37~)decane1carboxamide
ZINC000009242614
ZINC09242614
ZINC9242614
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