Vitas-M small molecule compound
5-[(5-acetyl-2-methoxybenzyl)sulfanyl]-6-(furan-2-ylmethyl)-3-phenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Catalog ID
STL133963
SMILES COc1ccc(cc1CSc1nc2c(c(=O)n1Cc1ccco1)sc(=S)n2c1ccccc1)C(=O)C
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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 C26H21N3O4S3 MW 535.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O4S3/c1-16(30)17-10-11-21(32-2)18(13-17)15-35-25-27-23-22(24(31)28(25)14-20-9-6-12-33-20)36-26(34)29(23)19-7-4-3-5-8-19/h3-13H,14-15H2,1-2H3InChIKey
RPEOUKHYKNSOBP-UHFFFAOYSA-NSynonyms
5((5acetyl2methoxybenzyl)sulfanyl)6(furan2ylmethyl)3phenyl2thioxo23dihydro(13)thiazolo(45d)pyrimidin7(6H)one
5((5ACETYL2METHOXYPHENYL)METHYLSULFANYL)6(FURAN2YLMETHYL)3PHENYL2SULFANYLIDENE(13)THIAZOLO(45D)PYRIMIDIN7ONE
CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C(=O)N2CC4=CC=CO4)SC(=S)N3C5=CC=CC=C5
InChI=1SC26H21N3O4S3c116(30)17101121(322)18(1317)153525272322(24(31)28(25)142096123320)3626(34)29(23)197435819h313H1415H212H3
MFCD05023503
ZINC000003018705
ZINC3018705
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