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N-[2-{[4-(dimethylamino)phenyl]amino}-1-(4-fluorophenyl)-2-oxoethyl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(2-methylbenzyl)acetamide

Catalog ID
STL438854
SMILES Fc1ccc(cc1)C(N(C(=O)CSc1nc(C)cc(n1)C)Cc1ccccc1C)C(=O)Nc1ccc(cc1)N(C)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 C32H34FN5O2S MW 571.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34FN5O2S/c1-21-8-6-7-9-25(21)19-38(29(39)20-41-32-34-22(2)18-23(3)35-32)30(24-10-12-26(33)13-11-24)31(40)36-27-14-16-28(17-15-27)37(4)5/h6-18,30H,19-20H2,1-5H3,(H,36,40)
InChIKey
KKYJLXAPEUQWJQ-UHFFFAOYSA-N
Synonyms

CC1=CC=CC=C1CN(C(C2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)N(C)C)C(=O)CSC4=NC(=CC(=N4)C)C
InChI=1SC32H34FN5O2Sc121867925(21)1938(29(39)2041323422(2)1823(3)3532)30(24101226(33)131124)31(40)3627141628(171527)37(4)5h61830H1920H215H3(H3640)
MFCD06243913
N(2((4(dimethylamino)phenyl)amino)1(4fluorophenyl)2oxoethyl)2((46dimethylpyrimidin2yl)sulfanyl)N(2methylbenzyl)acetamide
N(4(dimethylamino)phenyl)2((2(46dimethylpyrimidin2yl)sulfanylacetyl)((2methylphenyl)methyl)amino)2(4fluorophenyl)acetamide
N(4(DIMETHYLAMINO)PHENYL)2(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(2METHYLBENZYL)ACETAMIDO)2(4FLUOROPHENYL)ACETAMIDE
N(4DIMETHYLAMINOPHENYL)2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((2METHYLPHENYL)METHYL)AMINO)2(4FLUOROPHENYL)ACETAMIDE
ZINC000003771788
ZINC000003771789

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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