Vitas-M small molecule compound
N-(4-fluorophenyl)-2-{[3-(4-fluorophenyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093477
SMILES O=C(Nc1ccc(cc1)F)CSc1nc2cc([nH]c2c(=O)n1c1ccc(cc1)F)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 C21H16F2N4O2S MW 426.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F2N4O2S/c1-12-10-17-19(24-12)20(29)27(16-8-4-14(23)5-9-16)21(26-17)30-11-18(28)25-15-6-2-13(22)3-7-15/h2-10,24H,11H2,1H3,(H,25,28)InChIKey
YDUDPMCMGQXONV-UHFFFAOYSA-NSynonyms
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)F)C4=CC=C(C=C4)F
InChI=1SC21H16F2N4O2Sc112101719(2412)20(29)27(168414(23)5916)21(2617)301118(28)25156213(22)3715h21024H11H21H3(H2528)
MFCD18787611
N(4fluorophenyl)2((3(4fluorophenyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(4fluorophenyl)2((3(4fluorophenyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
O=C(Nc1ccc(cc1)F)CSc1nc2cc((nH)c2c(=O)n1c1ccc(cc1)F)C
ZINC000067237373
ZINC67237373
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