Vitas-M small molecule compound
ethyl 2-[({[3-(furan-2-ylmethyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL093289
SMILES CCOC(=O)c1ccccc1NC(=O)CSc1nc2cc([nH]c2c(=O)n1Cc1ccco1)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 C23H22N4O5S MW 466.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O5S/c1-3-31-22(30)16-8-4-5-9-17(16)25-19(28)13-33-23-26-18-11-14(2)24-20(18)21(29)27(23)12-15-7-6-10-32-15/h4-11,24H,3,12-13H2,1-2H3,(H,25,28)InChIKey
DFUYXIKGDSWTRO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CO4)NC(=C3)C
CCOC(=O)c1ccccc1NC(=O)CSc1nc2cc((nH)c2c(=O)n1Cc1ccco1)C
ethyl2((((3(furan2ylmethyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
ethyl2((2((3(furan2ylmethyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
InChI=1SC23H22N4O5Sc133122(30)16845917(16)2519(28)13332326181114(2)2420(18)21(29)27(23)121576103215h41124H31213H212H3(H2528)
MFCD18787423
ZINC000067236344
ZINC67236344
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