Vitas-M small molecule compound
ethyl 2-(1,3-benzothiazol-2-ylamino)-4-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}pyrimidine-5-carboxylate
Catalog ID
STK233668
SMILES CCOC(=O)c1cnc(nc1CSc1nccc(n1)C)Nc1nc2c(s1)cccc2
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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 C20H18N6O2S2 MW 438.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O2S2/c1-3-28-17(27)13-10-22-18(26-20-25-14-6-4-5-7-16(14)30-20)24-15(13)11-29-19-21-9-8-12(2)23-19/h4-10H,3,11H2,1-2H3,(H,22,24,25,26)InChIKey
MOOMFALCAZGADS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1CSC2=NC=CC(=N2)C)NC3=NC4=CC=CC=C4S3
ethyl2(13benzothiazol2ylamino)4(((4methylpyrimidin2yl)sulfanyl)methyl)pyrimidine5carboxylate
ETHYL2(13BENZOTHIAZOL2YLAMINO)4((4METHYLPYRIMIDIN2YL)SULFANYLMETHYL)PYRIMIDINE5CARBOXYLATE
ETHYL2(BENZOTHIAZOL2YLAMINO)4((4METHYLPYRIMIDIN2YLTHIO)METHYL)PYRIMIDINE5CARBOXYLATE
InChI=1SC20H18N6O2S2c132817(27)13102218(26202514645716(14)3020)2415(13)112919219812(2)2319h410H311H212H3(H22242526)
MFCD06752945
ZINC000006599997
ZINC06599997
ZINC6599997
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