Vitas-M small molecule compound
2-phenylethyl 4-({[2-({4-[(3-methylbutanoyl)amino]phenyl}carbonyl)hydrazinyl]carbonothioyl}amino)-4-oxobutanoate
Catalog ID
STL065002
SMILES CC(CC(=O)Nc1ccc(cc1)C(=O)NNC(=S)NC(=O)CCC(=O)OCCc1ccccc1)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 C25H30N4O5S MW 498.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O5S/c1-17(2)16-22(31)26-20-10-8-19(9-11-20)24(33)28-29-25(35)27-21(30)12-13-23(32)34-15-14-18-6-4-3-5-7-18/h3-11,17H,12-16H2,1-2H3,(H,26,31)(H,28,33)(H2,27,29,30,35)InChIKey
LGRMTSCXQMPUSM-UHFFFAOYSA-NSynonyms
2phenylethyl4(((2((4((3methylbutanoyl)amino)phenyl)carbonyl)hydrazinyl)carbonothioyl)amino)4oxobutanoate
2phenylethyl4(((4(3methylbutanoylamino)benzoyl)amino)carbamothioylamino)4oxobutanoate
CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)CCC(=O)OCCC2=CC=CC=C2
InChI=1SC25H30N4O5Sc117(2)1622(31)262010819(91120)24(33)282925(35)2721(30)121323(32)341514186435718h31117H1216H212H3(H2631)(H2833)(H227293035)
MFCD05880366
PHENETHYL4(((4(3METHYLBUTANOYLAMINO)BENZOYL)AMINO)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
ZINC000012137608
ZINC12137608
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