Vitas-M small molecule compound

N-benzyl-N-[1-(3,4-dimethoxyphenyl)-2-{[4-(dimethylamino)phenyl]amino}-2-oxoethyl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetamide

Catalog ID
STL438843
SMILES COc1ccc(cc1OC)C(N(C(=O)CSc1nc(C)cc(n1)C)Cc1ccccc1)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 C33H37N5O4S MW 599.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H37N5O4S/c1-22-18-23(2)35-33(34-22)43-21-30(39)38(20-24-10-8-7-9-11-24)31(25-12-17-28(41-5)29(19-25)42-6)32(40)36-26-13-15-27(16-14-26)37(3)4/h7-19,31H,20-21H2,1-6H3,(H,36,40)
InChIKey
LSOHQRHJGPIKHH-UHFFFAOYSA-N
Synonyms

2(benzyl(2(46dimethylpyrimidin2yl)sulfanylacetyl)amino)2(34dimethoxyphenyl)N(4(dimethylamino)phenyl)acetamide
2(BENZYL(2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)AMINO)2(34DIMETHOXYPHENYL)N(4DIMETHYLAMINOPHENYL)ACETAMIDE
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=CC=C2)C(C3=CC(=C(C=C3)OC)OC)C(=O)NC4=CC=C(C=C4)N(C)C)C
InChI=1SC33H37N5O4Sc1221823(2)3533(3422)432130(39)38(2024108791124)31(25121728(415)29(1925)426)32(40)3626131527(161426)37(3)4h71931H2021H216H3(H3640)
MFCD06243902
NbenzylN(1(34dimethoxyphenyl)2((4(dimethylamino)phenyl)amino)2oxoethyl)2((46dimethylpyrimidin2yl)sulfanyl)acetamide
NBENZYLN(1(34DIMETHOXYPHENYL)2(4(DIMETHYLAMINO)PHENYLAMINO)2OXOETHYL)2(46DIMETHYLPYRIMIDIN2YLTHIO)ACETAMIDE
ZINC000008695701
ZINC000008695702

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Available files

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