Vitas-M small molecule compound
2-[(1,5-dicyano-4-hydroxy-3-azaspiro[5.5]undeca-1,3-dien-2-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide
Catalog ID
STL044246
SMILES N#CC1C(=NC(=C(C21CCCCC2)C#N)SCC(=O)Nc1ccc(cc1C)C)O
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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 C22H24N4O2S MW 408.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O2S/c1-14-6-7-18(15(2)10-14)25-19(27)13-29-21-17(12-24)22(8-4-3-5-9-22)16(11-23)20(28)26-21/h6-7,10,16H,3-5,8-9,13H2,1-2H3,(H,25,27)(H,26,28)InChIKey
YPSQXYPLCZTDKM-UHFFFAOYSA-NSynonyms
2((15dicyano2oxo3azaspiro(55)undec4en4yl)sulfanyl)N(24dimethylphenyl)acetamide
2((15dicyano4hydroxy3azaspiro(55)undeca13dien2yl)sulfanyl)N(24dimethylphenyl)acetamide
2((711DICYANO8OXO9AZASPIRO(55)UNDEC10EN10YL)SULFANYL)N(24DIMETHYLPHENYL)ACETAMIDE
CC1=CC(=C(C=C1)NC(=O)CSC2=C(C3(CCCCC3)C(C(=O)N2)C#N)C#N)C
InChI=1SC22H24N4O2Sc1146718(15(2)1014)2519(27)13292117(1224)22(8435922)16(1123)20(28)2621h671016H358913H212H3(H2527)(H2628)
MFCD03817933
ZINC000001254573
ZINC000001254574
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