Vitas-M small molecule compound
N-[3-({[(4,6-diaminopyrimidin-2-yl)sulfanyl]acetyl}amino)phenyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STK359512
SMILES O=C(Nc1cccc(c1)NC(=O)C12CC3CC(C2)CC(C1)C3)CSc1nc(N)cc(n1)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 C23H28N6O2S MW 452.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N6O2S/c24-18-8-19(25)29-22(28-18)32-12-20(30)26-16-2-1-3-17(7-16)27-21(31)23-9-13-4-14(10-23)6-15(5-13)11-23/h1-3,7-8,13-15H,4-6,9-12H2,(H,26,30)(H,27,31)(H4,24,25,28,29)InChIKey
YCBHVIOIKDIZET-UHFFFAOYSA-NSynonyms
C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC(=CC=C4)NC(=O)CSC5=NC(=CC(=N5)N)N
InChI=1SC23H28N6O2Sc2418819(25)2922(2818)321220(30)261621317(716)2721(31)23913414(1023)615(513)1123h13781315H46912H2(H2630)(H2731)(H424252829)
MFCD11696263
N(3((((46diaminopyrimidin2yl)sulfanyl)acetyl)amino)phenyl)tricyclo(3311~37~)decane1carboxamide
N(3((2(46diaminopyrimidin2yl)sulfanylacetyl)amino)phenyl)adamantane1carboxamide
ZINC000020102709
ZINC20102709
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