Vitas-M small molecule compound
N-butyl-N-ethyl-2-{[3-(4-fluorophenyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL103780
SMILES CCCCN(C(=O)CSc1nc2cc([nH]c2c(=O)n1c1ccc(cc1)F)C)CC
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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 C21H25FN4O2S MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25FN4O2S/c1-4-6-11-25(5-2)18(27)13-29-21-24-17-12-14(3)23-19(17)20(28)26(21)16-9-7-15(22)8-10-16/h7-10,12,23H,4-6,11,13H2,1-3H3InChIKey
DETPFPLWXVSLTF-UHFFFAOYSA-NSynonyms
CCCCN(C(=O)CSc1nc2cc((nH)c2c(=O)n1c1ccc(cc1)F)C)CC
CCCCN(CC)C(=O)CSC1=NC2=C(C(=O)N1C3=CC=C(C=C3)F)NC(=C2)C
InChI=1SC21H25FN4O2Sc1461125(52)18(27)13292124171214(3)2319(17)20(28)26(21)169715(22)81016h7101223H461113H213H3
MFCD20735382
NbutylNethyl2((3(4fluorophenyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
NbutylNethyl2((3(4fluorophenyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067237344
ZINC67237344
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