Vitas-M small molecule compound
5-bromo-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(ethylsulfonyl)pyrimidine-4-carboxamide
Catalog ID
STK518484
SMILES N#Cc1c(NC(=O)c2nc(ncc2Br)S(=O)(=O)CC)sc2c1CCCC2
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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 C16H15BrN4O3S2 MW 455.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4O3S2/c1-2-26(23,24)16-19-8-11(17)13(20-16)14(22)21-15-10(7-18)9-5-3-4-6-12(9)25-15/h8H,2-6H2,1H3,(H,21,22)InChIKey
ZJBOJEVHEWRMNB-UHFFFAOYSA-NSynonyms
5bromoN(3cyano4567tetrahydro1benzothiophen2yl)2(ethylsulfonyl)pyrimidine4carboxamide
5bromoN(3cyano4567tetrahydro1benzothiophen2yl)2ethylsulfonylpyrimidine4carboxamide
CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br
InChI=1SC16H15BrN4O3S2c1226(2324)1619811(17)13(2016)14(22)211510(718)9534612(9)2515h8H26H21H3(H2122)
MFCD12918154
ZINC000027748965
ZINC27748965
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