Vitas-M small molecule compound
2-{[5-(4-methoxybenzyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]acetamide
Catalog ID
STK772499
SMILES COc1ccc(cc1)Cc1nnc(n1c1ccccc1)SCC(=O)NC(C12CC3CC(C2)CC(C1)C3)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 C30H36N4O2S MW 516.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N4O2S/c1-20(30-16-22-12-23(17-30)14-24(13-22)18-30)31-28(35)19-37-29-33-32-27(34(29)25-6-4-3-5-7-25)15-21-8-10-26(36-2)11-9-21/h3-11,20,22-24H,12-19H2,1-2H3,(H,31,35)InChIKey
GPGSMJCLQAOARI-UHFFFAOYSA-NSynonyms
634167-60-52((5(4methoxybenzyl)4phenyl4H124triazol3yl)sulfanyl)N(1(tricyclo(3311~37~)dec1yl)ethyl)acetamide
634167605
CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CSC4=NN=C(N4C5=CC=CC=C5)CC6=CC=C(C=C6)OC
InChI=1SC30H36N4O2Sc120(3016221223(1730)1424(1322)1830)3128(35)193729333227(34(29)256435725)152181026(362)11921h311202224H1219H212H3(H3135)
N(1((3r5r7r)adamantan1yl)ethyl)2((5(4methoxybenzyl)4phenyl4H124triazol3yl)thio)acetamide
N(1(1ADAMANTYL)ETHYL)2((5((4METHOXYPHENYL)METHYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000008738841
ZINC000008741134
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