Vitas-M small molecule compound
2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide
Catalog ID
STL345991
SMILES O=C(NC12CC3CC(C2)CC(C1)C3)CSc1nnc(n1C)c1ccc(cc1)N
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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 C21H27N5OS MW 397.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5OS/c1-26-19(16-2-4-17(22)5-3-16)24-25-20(26)28-12-18(27)23-21-9-13-6-14(10-21)8-15(7-13)11-21/h2-5,13-15H,6-12,22H2,1H3,(H,23,27)InChIKey
CYKGKEDNUDNGFO-UHFFFAOYSA-NSynonyms
627056-39-72((5(4aminophenyl)4methyl4H124triazol3yl)sulfanyl)N(tricyclo(3311~37~)dec1yl)acetamide
627056397
CN1C(=NN=C1SCC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=C(C=C5)N
InChI=1SC21H27N5OSc12619(162417(22)5316)242520(26)281218(27)2321913614(1021)815(713)1121h251315H61222H21H3(H2327)
N((1s3s)adamantan1yl)2((5(4aminophenyl)4methyl4H124triazol3yl)thio)acetamide
N(1ADAMANTYL)2((5(4AMINOPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000005249658
ZINC05249658
ZINC5249658
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