Vitas-M small molecule compound
methyl (2Z)-2-({[1-(2-fluorobenzyl)-5-oxopyrrolidin-3-yl]carbonyl}imino)-5-methyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL407490
SMILES COC(=O)c1[nH]/c(=N/C(=O)C2CC(=O)N(C2)Cc2ccccc2F)/sc1C
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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 C18H18FN3O4S MW 391.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18FN3O4S/c1-10-15(17(25)26-2)20-18(27-10)21-16(24)12-7-14(23)22(9-12)8-11-5-3-4-6-13(11)19/h3-6,12H,7-9H2,1-2H3,(H,20,21,24)InChIKey
HOLJVVSSDRLCKJ-UHFFFAOYSA-NSynonyms
1574529-51-31574529513
CC1=C(N=C(S1)NC(=O)C2CC(=O)N(C2)CC3=CC=CC=C3F)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)C2CC(=O)N(C2)Cc2ccccc2F)sc1C
InChI=1SC18H18FN3O4Sc11015(17(25)262)2018(2710)2116(24)12714(23)22(912)811534613(11)19h3612H79H212H3(H202124)
methyl(2Z)2(((1(2fluorobenzyl)5oxopyrrolidin3yl)carbonyl)imino)5methyl23dihydro13thiazole4carboxylate
methyl2((1((2fluorophenyl)methyl)5oxopyrrolidine3carbonyl)amino)5methyl13thiazole4carboxylate
MFCD30704769
ZINC000096223050
ZINC000096223052
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