Vitas-M small molecule compound

N-(4-ethylphenyl)-2-{[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

Catalog ID
STL085052
SMILES CCc1ccc(cc1)NC(=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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-2-16-9-11-17(12-10-16)26-21(29)15-33-25-27-22-19-7-3-4-8-20(19)32-23(22)24(30)28(25)14-18-6-5-13-31-18/h3-4,7-12,18H,2,5-6,13-15H2,1H3,(H,26,29)
InChIKey
VPBOEMFMDTUDGR-UHFFFAOYSA-N
Synonyms
900002-94-0
900002940
CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC4CCCO4)OC5=CC=CC=C53
InChI=1SC25H25N3O4Sc121691117(121016)2621(29)153325272219734820(19)3223(22)24(30)28(25)141865133118h3471218H2561315H21H3(H2629)
MFCD07650731
N(4ETHYLPHENYL)2((4OXO3((TETRAHYDROFURAN2YL)METHYL)34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)ACETAMIDE
N(4ethylphenyl)2((4oxo3(oxolan2ylmethyl)(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(4ethylphenyl)2((4oxo3(tetrahydrofuran2ylmethyl)34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009750797
ZINC000009750807

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Available files

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