Vitas-M small molecule compound
8-ethyl-2-{4-[(2-fluorophenyl)carbamothioyl]piperazin-1-yl}-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
Catalog ID
STK778265
SMILES CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)Nc1ccccc1F
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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 C21H21FN6O3S MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN6O3S/c1-2-26-12-14(19(30)31)17(29)13-11-23-20(25-18(13)26)27-7-9-28(10-8-27)21(32)24-16-6-4-3-5-15(16)22/h3-6,11-12H,2,7-10H2,1H3,(H,24,32)(H,30,31)InChIKey
MTNBCQYXZPFIAM-UHFFFAOYSA-NSynonyms
697239-67-12(4(((2FLUOROPHENYL)AMINO)CARBONOTHIOYL)1PIPERAZINYL)8ETHYL5OXO58DIHYDROPYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
697239671
8ethyl2(4((2fluorophenyl)carbamothioyl)piperazin1yl)5oxo58dihydropyrido(23d)pyrimidine6carboxylicacid
8ETHYL2(4((2FLUOROPHENYL)CARBAMOTHIOYL)PIPERAZIN1YL)5OXOPYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC4=CC=CC=C4F)C(=O)O
InChI=1SC21H21FN6O3Sc12261214(19(30)31)17(29)13112320(2518(13)26)277928(10827)21(32)2416643515(16)22h361112H2710H21H3(H2432)(H3031)
MFCD04167175
ZINC000001271962
ZINC1271962
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