Vitas-M small molecule compound
N-{2-(1,3-benzodioxol-5-ylamino)-2-oxo-1-[4-(propan-2-yl)phenyl]ethyl}-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(pyridin-3-ylmethyl)acetamide
Catalog ID
STL438772
SMILES Cc1nc(SCC(=O)N(C(C(=O)Nc2ccc3c(c2)OCO3)c2ccc(cc2)C(C)C)Cc2cccnc2)nc(c1)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 C32H33N5O4S MW 583.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N5O4S/c1-20(2)24-7-9-25(10-8-24)30(31(39)36-26-11-12-27-28(15-26)41-19-40-27)37(17-23-6-5-13-33-16-23)29(38)18-42-32-34-21(3)14-22(4)35-32/h5-16,20,30H,17-19H2,1-4H3,(H,36,39)InChIKey
DYYYDEAFKYZCHP-UHFFFAOYSA-NSynonyms
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CN=CC=C2)C(C3=CC=C(C=C3)C(C)C)C(=O)NC4=CC5=C(C=C4)OCO5)C
InChI=1SC32H33N5O4Sc120(2)247925(10824)30(31(39)362611122728(1526)41194027)37(17236513331623)29(38)1842323421(3)1422(4)3532h5162030H1719H214H3(H3639)
MFCD06243878
N(13BENZODIOXOL5YL)2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)(PYRIDIN3YLMETHYL)AMINO)2(4PROPAN2YLPHENYL)ACETAMIDE
N(2(13benzodioxol5ylamino)2oxo1(4(propan2yl)phenyl)ethyl)2((46dimethylpyrimidin2yl)sulfanyl)N(pyridin3ylmethyl)acetamide
N(BENZO(D)(13)DIOXOL5YL)2(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(PYRIDIN3YLMETHYL)ACETAMIDO)2(4ISOPROPYLPHENYL)ACETAMIDE
ZINC000001407830
ZINC000001407831
Check stock
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Check stock on Vitas-MAvailable files
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