Vitas-M small molecule compound

methyl N-{[(7-hydroxy-3-phenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetyl}glycinate

Catalog ID
STK614342
SMILES COC(=O)CNC(=O)CSc1nc(O)c2c(n1)n(c1ccccc1)c(=S)s2

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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 C16H14N4O4S3 MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O4S3/c1-24-11(22)7-17-10(21)8-26-15-18-13-12(14(23)19-15)27-16(25)20(13)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,17,21)(H,18,19,23)
InChIKey
XWDFJRXRPCXKBR-UHFFFAOYSA-N
Synonyms
904009-29-6
904009296
COC(=O)CNC(=O)CSC1=NC(=O)C2=C(N1)N(C(=S)S2)C3=CC=CC=C3
InChI=1SC16H14N4O4S3c12411(22)71710(21)82615181312(14(23)1915)2716(25)20(13)9532469h26H78H21H3(H1721)(H181923)
methyl2((2((7oxo3phenyl2sulfanylidene4H(13)thiazolo(45d)pyrimidin5yl)sulfanyl)acetyl)amino)acetate
methylN(((7hydroxy3phenyl2thioxo23dihydro(13)thiazolo(45d)pyrimidin5yl)sulfanyl)acetyl)glycinate
MFCD08730014
ZINC000015952031
ZINC15952031

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Available files

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