Vitas-M small molecule compound
2-{[3-(4-fluorophenyl)-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(furan-2-ylmethyl)acetamide
Catalog ID
STL093467
SMILES O=C(NCc1ccco1)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 C20H17FN4O3S MW 412.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN4O3S/c1-12-9-16-18(23-12)19(27)25(14-6-4-13(21)5-7-14)20(24-16)29-11-17(26)22-10-15-3-2-8-28-15/h2-9,23H,10-11H2,1H3,(H,22,26)InChIKey
GRLNYZIHSZNNFG-UHFFFAOYSA-NSynonyms
2((3(4fluorophenyl)6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(furan2ylmethyl)acetamide
2((3(4fluorophenyl)6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(furan2ylmethyl)acetamide
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=CO3)C4=CC=C(C=C4)F
InChI=1SC20H17FN4O3Sc11291618(2312)19(27)25(146413(21)5714)20(2416)291117(26)2210153282815h2923H1011H21H3(H2226)
MFCD18787601
O=C(NCc1ccco1)CSc1nc2cc((nH)c2c(=O)n1c1ccc(cc1)F)C
ZINC000067237294
ZINC67237294
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