Vitas-M small molecule compound
N-[1-(cyclohex-3-en-1-yl)-2-{[4-(dimethylamino)phenyl]amino}-2-oxoethyl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-methoxybenzyl)acetamide
Catalog ID
STL438850
SMILES COc1ccc(cc1)CN(C(C(=O)Nc1ccc(cc1)N(C)C)C1CCC=CC1)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 C32H39N5O3S MW 573.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H39N5O3S/c1-22-19-23(2)34-32(33-22)41-21-29(38)37(20-24-11-17-28(40-5)18-12-24)30(25-9-7-6-8-10-25)31(39)35-26-13-15-27(16-14-26)36(3)4/h6-7,11-19,25,30H,8-10,20-21H2,1-5H3,(H,35,39)InChIKey
KTQVYDBTUZGTPZ-UHFFFAOYSA-NSynonyms
2(CYCLOHEX3ENYL)N(4(DIMETHYLAMINO)PHENYL)2(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(4METHOXYBENZYL)ACETAMIDO)ACETAMIDE
2cyclohex3en1ylN(4(dimethylamino)phenyl)2((2(46dimethylpyrimidin2yl)sulfanylacetyl)((4methoxyphenyl)methyl)amino)acetamide
2CYCLOHEX3EN1YLN(4DIMETHYLAMINOPHENYL)2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((4METHOXYPHENYL)METHYL)AMINO)ACETAMIDE
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=C(C=C2)OC)C(C3CCC=CC3)C(=O)NC4=CC=C(C=C4)N(C)C)C
InChI=1SC32H39N5O3Sc1221923(2)3432(3322)412129(38)37(2024111728(405)181224)30(2597681025)31(39)3526131527(161426)36(3)4h6711192530H8102021H215H3(H3539)
MFCD06243909
N(1(cyclohex3en1yl)2((4(dimethylamino)phenyl)amino)2oxoethyl)2((46dimethylpyrimidin2yl)sulfanyl)N(4methoxybenzyl)acetamide
ZINC000008695707
ZINC000008695710
Check stock
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Check stock on Vitas-MAvailable files
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