Vitas-M small molecule compound
8-ethyl-5-oxo-2-{4-[(pyridin-3-ylcarbonyl)carbamothioyl]piperazin-1-yl}-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
Catalog ID
STK333657
SMILES CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)NC(=O)c1cccnc1
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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 C21H21N7O4S MW 467.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N7O4S/c1-2-26-12-15(19(31)32)16(29)14-11-23-20(24-17(14)26)27-6-8-28(9-7-27)21(33)25-18(30)13-4-3-5-22-10-13/h3-5,10-12H,2,6-9H2,1H3,(H,31,32)(H,25,30,33)InChIKey
JJOLMGHFOPKPAR-UHFFFAOYSA-NSynonyms
370582-32-4370582324
8ethyl2(4(nicotinoylcarbamothioyl)piperazin1yl)5oxo58dihydropyrido(23d)pyrimidine6carboxylicacid
8ethyl5oxo2(4((pyridin3ylcarbonyl)carbamothioyl)piperazin1yl)58dihydropyrido(23d)pyrimidine6carboxylicacid
8ETHYL5OXO2(4(PYRIDINE3CARBONYLCARBAMOTHIOYL)PIPERAZIN1YL)PYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC(=O)C4=CN=CC=C4)C(=O)O
InChI=1SC21H21N7O4Sc12261215(19(31)32)16(29)14112320(2417(14)26)276828(9727)21(33)2518(30)13435221013h351012H269H21H3(H3132)(H253033)
MFCD01994203
ZINC000002316721
ZINC2316721
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