Vitas-M small molecule compound

N-(4-bromophenyl)-2-[(3-ethyl-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide

Catalog ID
STK829866
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)Br)nc2c(c1=O)c1CCN(Cc1s2)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 C20H21BrN4O2S2 MW 493.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN4O2S2/c1-3-25-19(27)17-14-8-9-24(2)10-15(14)29-18(17)23-20(25)28-11-16(26)22-13-6-4-12(21)5-7-13/h4-7H,3,8-11H2,1-2H3,(H,22,26)
InChIKey
HCIUYGQWQIFWSE-UHFFFAOYSA-N
Synonyms
578698-15-4
578698154
CCN1C(=O)C2=C(N=C1SCC(=O)NC3=CC=C(C=C3)Br)SC4=C2CCN(C4)C
InChI=1SC20H21BrN4O2S2c132519(27)17148924(2)1015(14)2918(17)2320(25)281116(26)22136412(21)5713h47H3811H212H3(H2226)
MFCD04029064
N(4bromophenyl)2((3ethyl7methyl4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4bromophenyl)2((3ethyl7methyl4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)thio)acetamide
N(4bromophenyl)2((3ethyl7methyl4oxo68dihydro5Hpyrido(23)thieno(24b)pyrimidin2yl)sulfanyl)acetamide
ZINC000020329547
ZINC20329547

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Available files

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