Vitas-M small molecule compound
N-[1-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(pyridin-3-ylmethyl)acetamide
Catalog ID
STL439124
SMILES Cc1nc(SCC(=O)N(C(c2ccc3c(c2)OCO3)C(=O)Nc2ccc3c(c2)OCO3)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 C30H27N5O6S MW 585.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O6S/c1-18-10-19(2)33-30(32-18)42-15-27(36)35(14-20-4-3-9-31-13-20)28(21-5-7-23-25(11-21)40-16-38-23)29(37)34-22-6-8-24-26(12-22)41-17-39-24/h3-13,28H,14-17H2,1-2H3,(H,34,37)InChIKey
ZRBKNXZMHFFCHC-UHFFFAOYSA-NSynonyms
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CN=CC=C2)C(C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC6=C(C=C5)OCO6)C
InChI=1SC30H27N5O6Sc1181019(2)3330(3218)421527(36)35(1420439311320)28(21572325(1121)40163823)29(37)3422682426(1222)41173924h31328H1417H212H3(H3437)
MFCD06243992
N(1(13benzodioxol5yl)2(13benzodioxol5ylamino)2oxoethyl)2((46dimethylpyrimidin2yl)sulfanyl)N(pyridin3ylmethyl)acetamide
N2BIS(13BENZODIOXOL5YL)2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)(PYRIDIN3YLMETHYL)AMINO)ACETAMIDE
N2DI(BENZO(D)(13)DIOXOL5YL)2(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(PYRIDIN3YLMETHYL)ACETAMIDO)ACETAMIDE
ZINC000008695867
ZINC000008695868
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