Vitas-M small molecule compound
methyl N-{[3-(3-fluorobenzyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-6-yl]carbonyl}-beta-alaninate
Catalog ID
STK933736
SMILES COC(=O)CCNC(=O)c1sc2c(c1C)c(=O)n(cn2)Cc1cccc(c1)F
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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 C19H18FN3O4S MW 403.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18FN3O4S/c1-11-15-18(28-16(11)17(25)21-7-6-14(24)27-2)22-10-23(19(15)26)9-12-4-3-5-13(20)8-12/h3-5,8,10H,6-7,9H2,1-2H3,(H,21,25)InChIKey
HOAKUJAESVWBAB-UHFFFAOYSA-NSynonyms
1190255-03-81190255038
CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=CC=C3)F)C(=O)NCCC(=O)OC
InChI=1SC19H18FN3O4Sc1111518(2816(11)17(25)217614(24)272)221023(19(15)26)91243513(20)812h35810H679H212H3(H2125)
methyl3((3((3fluorophenyl)methyl)5methyl4oxothieno(23d)pyrimidine6carbonyl)amino)propanoate
methyl3(3(3fluorobenzyl)5methyl4oxo34dihydrothieno(23d)pyrimidine6carboxamido)propanoate
methylN((3(3fluorobenzyl)5methyl4oxo34dihydrothieno(23d)pyrimidin6yl)carbonyl)betaalaninate
MFCD13760018
ZINC000036360930
ZINC36360930
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