Vitas-M small molecule compound
N-[4-(dimethylamino)phenyl]-1-[{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}(4-methylbenzyl)amino]cyclohexanecarboxamide
Catalog ID
STL437554
SMILES Cc1ccc(cc1)CN(C1(CCCCC1)C(=O)Nc1ccc(cc1)N(C)C)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 C31H39N5O2S MW 545.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H39N5O2S/c1-22-9-11-25(12-10-22)20-36(28(37)21-39-30-32-23(2)19-24(3)33-30)31(17-7-6-8-18-31)29(38)34-26-13-15-27(16-14-26)35(4)5/h9-16,19H,6-8,17-18,20-21H2,1-5H3,(H,34,38)InChIKey
USQODNMNIDFNFN-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)CN(C(=O)CSC2=NC(=CC(=N2)C)C)C3(CCCCC3)C(=O)NC4=CC=C(C=C4)N(C)C
InChI=1SC31H39N5O2Sc12291125(121022)2036(28(37)2139303223(2)1924(3)3330)31(177681831)29(38)3426131527(161426)35(4)5h91619H6817182021H215H3(H3438)
MFCD06243872
N(4(dimethylamino)phenyl)1((((46dimethylpyrimidin2yl)sulfanyl)acetyl)(4methylbenzyl)amino)cyclohexanecarboxamide
N(4(dimethylamino)phenyl)1((2(46dimethylpyrimidin2yl)sulfanylacetyl)((4methylphenyl)methyl)amino)cyclohexane1carboxamide
N(4(DIMETHYLAMINO)PHENYL)1(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(4METHYLBENZYL)ACETAMIDO)CYCLOHEXANECARBOXAMIDE
N(4DIMETHYLAMINOPHENYL)1((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((4METHYLPHENYL)METHYL)AMINO)CYCLOHEXANE1CARBOXAMIDE
ZINC000008694444
ZINC8694444
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