Vitas-M small molecule compound
3-phenylpropyl 5-{[(3-cyano-4,6-dimethyl-2-oxopyridin-1(2H)-yl)carbamothioyl]amino}-5-oxopentanoate
Catalog ID
STL065292
SMILES N#Cc1c(C)cc(n(c1=O)NC(=S)NC(=O)CCCC(=O)OCCCc1ccccc1)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 C23H26N4O4S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O4S/c1-16-14-17(2)27(22(30)19(16)15-24)26-23(32)25-20(28)11-6-12-21(29)31-13-7-10-18-8-4-3-5-9-18/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H2,25,26,28,32)InChIKey
ROPWZFAPBCXWDO-UHFFFAOYSA-NSynonyms
3phenylpropyl5(((3cyano46dimethyl2oxopyridin1(2H)yl)carbamothioyl)amino)5oxopentanoate
3PHENYLPROPYL5((3CYANO46DIMETHYL2OXOPYRIDIN1YL)CARBAMOTHIOYLAMINO)5OXOPENTANOATE
CC1=CC(=C(C(=O)N1NC(=S)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2)C#N)C
InChI=1SC23H26N4O4Sc1161417(2)27(22(30)19(16)1524)2623(32)2520(28)1161221(29)3113710188435918h358914H671013H212H3(H225262832)
MFCD07083787
ZINC000012137519
ZINC12137519
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