Vitas-M small molecule compound
N-{4-[4-(azepan-1-ylsulfonyl)phenyl]-1,3-thiazol-2-yl}-5-chloro-2-(methylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STK909926
SMILES CSc1ncc(c(n1)C(=O)Nc1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCCCCC1)Cl
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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 C21H22ClN5O3S3 MW 524.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5O3S3/c1-31-20-23-12-16(22)18(25-20)19(28)26-21-24-17(13-32-21)14-6-8-15(9-7-14)33(29,30)27-10-4-2-3-5-11-27/h6-9,12-13H,2-5,10-11H2,1H3,(H,24,26,28)InChIKey
IJFJVPZFVYLZHI-UHFFFAOYSA-NSynonyms
CSC1=NC=C(C(=N1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4)Cl
InChI=1SC21H22ClN5O3S3c13120231216(22)18(2520)19(28)26212417(133221)146815(9714)33(2930)271042351127h691213H251011H21H3(H242628)
MFCD06629654
N(4(4(azepan1ylsulfonyl)phenyl)13thiazol2yl)5chloro2(methylsulfanyl)pyrimidine4carboxamide
N(4(4(AZEPAN1YLSULFONYL)PHENYL)13THIAZOL2YL)5CHLORO2METHYLSULFANYLPYRIMIDINE4CARBOXAMIDE
ZINC000059626831
ZINC59626831
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