Vitas-M small molecule compound
N-(4-methoxybenzyl)-2-{[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL085069
SMILES COc1ccc(cc1)CNC(=O)CSc1nc2c3ccccc3oc2c(=O)n1CC1CCCO1
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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 C25H25N3O5S MW 479.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5S/c1-31-17-10-8-16(9-11-17)13-26-21(29)15-34-25-27-22-19-6-2-3-7-20(19)33-23(22)24(30)28(25)14-18-5-4-12-32-18/h2-3,6-11,18H,4-5,12-15H2,1H3,(H,26,29)InChIKey
CHPXMQJLAZVBDE-UHFFFAOYSA-NSynonyms
900003-06-7900003067
COC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2CC4CCCO4)OC5=CC=CC=C53
InChI=1SC25H25N3O5Sc1311710816(91117)132621(29)153425272219623720(19)3323(22)24(30)28(25)141854123218h2361118H451215H21H3(H2629)
MFCD07650746
N((4methoxyphenyl)methyl)2((4oxo3(oxolan2ylmethyl)(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(4METHOXYBENZYL)2((4OXO3((TETRAHYDROFURAN2YL)METHYL)34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)ACETAMIDE
N(4methoxybenzyl)2((4oxo3(tetrahydrofuran2ylmethyl)34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009751129
ZINC000009751137
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