Vitas-M small molecule compound
1-(6-{2-[(2-chloro-5-fluorophenyl)amino]-2-oxoethyl}-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-ethylpiperidine-3-carboxamide
Catalog ID
STL093067
SMILES CCNC(=O)C1CCCN(C1)c1nc2c(s1)c(=O)n(cn2)CC(=O)Nc1cc(F)ccc1Cl
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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 C21H22ClFN6O3S MW 492.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClFN6O3S/c1-2-24-19(31)12-4-3-7-28(9-12)21-27-18-17(33-21)20(32)29(11-25-18)10-16(30)26-15-8-13(23)5-6-14(15)22/h5-6,8,11-12H,2-4,7,9-10H2,1H3,(H,24,31)(H,26,30)InChIKey
AFRBIAXIJNSGLX-UHFFFAOYSA-NSynonyms
1(6(2((2chloro5fluorophenyl)amino)2oxoethyl)7oxo67dihydro(13)thiazolo(45d)pyrimidin2yl)Nethylpiperidine3carboxamide
1(6(2(2chloro5fluoroanilino)2oxoethyl)7oxo(13)thiazolo(45d)pyrimidin2yl)Nethylpiperidine3carboxamide
CCNC(=O)C1CCCN(C1)C2=NC3=C(S2)C(=O)N(C=N3)CC(=O)NC4=C(C=CC(=C4)F)Cl
InChI=1SC21H22ClFN6O3Sc122419(31)1243728(912)21271817(3321)20(32)29(112518)1016(30)2615813(23)5614(15)22h5681112H247910H21H3(H2431)(H2630)
MFCD18787202
ZINC000067226368
ZINC000067226370
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