Vitas-M small molecule compound
methyl 2-({[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)-1,3-benzothiazole-6-carboxylate
Catalog ID
STK231332
SMILES COC(=O)c1ccc2c(c1)sc(n2)NC(=O)CSc1nc(C)cc(=O)[nH]1
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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 C16H14N4O4S2 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O4S2/c1-8-5-12(21)19-15(17-8)25-7-13(22)20-16-18-10-4-3-9(14(23)24-2)6-11(10)26-16/h3-6H,7H2,1-2H3,(H,17,19,21)(H,18,20,22)InChIKey
GPZCOGWLIGFNDC-UHFFFAOYSA-NSynonyms
312510-54-6312510546
CC1=CC(=O)N=C(N1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC
COC(=O)c1ccc2c(c1)sc(n2)NC(=O)CSc1nc(C)cc(=O)(nH)1
InChI=1SC16H14N4O4S2c18512(21)1915(178)25713(22)20161810439(14(23)242)611(10)2616h36H7H212H3(H171921)(H182022)
methyl2((((4methyl6oxo16dihydropyrimidin2yl)sulfanyl)acetyl)amino)13benzothiazole6carboxylate
METHYL2((2((6METHYL4OXO1HPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
MFCD01461643
ZINC000002972305
ZINC02972305
ZINC2972305
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