Vitas-M small molecule compound
N-ethyl-1-(6-{2-[(4-fluorobenzyl)amino]-2-oxoethyl}-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl)piperidine-3-carboxamide
Catalog ID
STL093057
SMILES CCNC(=O)C1CCCN(C1)c1nc2c(s1)c(=O)n(cn2)CC(=O)NCc1ccc(cc1)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 C22H25FN6O3S MW 472.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25FN6O3S/c1-2-24-20(31)15-4-3-9-28(11-15)22-27-19-18(33-22)21(32)29(13-26-19)12-17(30)25-10-14-5-7-16(23)8-6-14/h5-8,13,15H,2-4,9-12H2,1H3,(H,24,31)(H,25,30)InChIKey
VKTUYAXBZTVYJX-UHFFFAOYSA-NSynonyms
CCNC(=O)C1CCCN(C1)C2=NC3=C(S2)C(=O)N(C=N3)CC(=O)NCC4=CC=C(C=C4)F
InChI=1SC22H25FN6O3Sc122420(31)1543928(1115)22271918(3322)21(32)29(132619)1217(30)2510145716(23)8614h581315H24912H21H3(H2431)(H2530)
MFCD15135529
Nethyl1(6(2((4fluorobenzyl)amino)2oxoethyl)7oxo67dihydro(13)thiazolo(45d)pyrimidin2yl)piperidine3carboxamide
Nethyl1(6(2((4fluorophenyl)methylamino)2oxoethyl)7oxo(13)thiazolo(45d)pyrimidin2yl)piperidine3carboxamide
ZINC000033141269
ZINC000033141270
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