Vitas-M small molecule compound
4-{4-[(3-fluorobenzyl)oxy]-3-methoxyphenyl}-3,4-dihydro-2H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-2,5(1H)-dione
Catalog ID
STK784592
SMILES COc1cc(ccc1OCc1cccc(c1)F)C1CC(=O)Nc2c1c(=O)nc1n2ccs1
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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 C23H18FN3O4S MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18FN3O4S/c1-30-18-10-14(5-6-17(18)31-12-13-3-2-4-15(24)9-13)16-11-19(28)25-21-20(16)22(29)26-23-27(21)7-8-32-23/h2-10,16H,11-12H2,1H3,(H,25,28)InChIKey
TXLVATKVQVFBFJ-UHFFFAOYSA-NSynonyms
4(4((3fluorobenzyl)oxy)3methoxyphenyl)34dihydro2Hpyrido(32e)(13)thiazolo(32a)pyrimidine25(1H)dione
COC1=C(C=CC(=C1)C2CC(=O)NC3=C2C(=O)N=C4N3C=CS4)OCC5=CC(=CC=C5)F
InChI=1SC23H18FN3O4Sc130181014(5617(18)31121332415(24)913)161119(28)252120(16)22(29)262327(21)783223h21016H1112H21H3(H2528)
MFCD07022663
ZINC000012419448
ZINC000012419451
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