Vitas-M small molecule compound
N-[2-(1,3-benzodioxol-5-ylamino)-1-(4-fluorophenyl)-2-oxoethyl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-methoxybenzyl)acetamide
Catalog ID
STL446784
SMILES COc1ccc(cc1)CN(C(C(=O)Nc1ccc2c(c1)OCO2)c1ccc(cc1)F)C(=O)CSc1nc(C)cc(n1)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 C31H29FN4O5S MW 588.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29FN4O5S/c1-19-14-20(2)34-31(33-19)42-17-28(37)36(16-21-4-11-25(39-3)12-5-21)29(22-6-8-23(32)9-7-22)30(38)35-24-10-13-26-27(15-24)41-18-40-26/h4-15,29H,16-18H2,1-3H3,(H,35,38)InChIKey
JEWNVTZJLFRZFG-UHFFFAOYSA-NSynonyms
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=C(C=C2)OC)C(C3=CC=C(C=C3)F)C(=O)NC4=CC5=C(C=C4)OCO5)C
InChI=1SC31H29FN4O5Sc1191420(2)3431(3319)421728(37)36(162141125(393)12521)29(226823(32)9722)30(38)352410132627(1524)41184026h41529H1618H213H3(H3538)
MFCD06243971
N(13BENZODIOXOL5YL)2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((4METHOXYPHENYL)METHYL)AMINO)2(4FLUOROPHENYL)ACETAMIDE
N(2(13benzodioxol5ylamino)1(4fluorophenyl)2oxoethyl)2((46dimethylpyrimidin2yl)sulfanyl)N(4methoxybenzyl)acetamide
N(BENZO(D)(13)DIOXOL5YL)2(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(4METHOXYBENZYL)ACETAMIDO)2(4FLUOROPHENYL)ACETAMIDE
ZINC000001407951
ZINC000001407956
Check stock
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Check stock on Vitas-MAvailable files
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