Vitas-M small molecule compound
8-ethyl-5-oxo-2-{4-[(phenylcarbonyl)carbamothioyl]piperazin-1-yl}-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
Catalog ID
STL333185
SMILES CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)NC(=O)c1ccccc1
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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 C22H22N6O4S MW 466.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O4S/c1-2-26-13-16(20(31)32)17(29)15-12-23-21(24-18(15)26)27-8-10-28(11-9-27)22(33)25-19(30)14-6-4-3-5-7-14/h3-7,12-13H,2,8-11H2,1H3,(H,31,32)(H,25,30,33)InChIKey
QSBIKLZVTIOBEG-UHFFFAOYSA-NSynonyms
400828-71-92(4(BENZAMIDO(SULFANYLIDENE)METHYL)1PIPERAZINYL)8ETHYL5OXO6PYRIDO(23D)PYRIMIDINECARBOXYLICACID
2(4(benzoylcarbamothioyl)piperazin1yl)8ethyl5oxo58dihydropyrido(23d)pyrimidine6carboxylicacid
2(4(BENZOYLCARBAMOTHIOYL)PIPERAZIN1YL)8ETHYL5OXOPYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
2(4(BENZOYLTHIOCARBAMOYL)PIPERAZINO)8ETHYL5KETOPYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
2(4BENZOYLAMINOCARBOTHIOYLPIPERAZIN1YL)8ETHYL5OXO58DIHYDROPYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
400828719
8ETHYL5OXIDANYLIDENE2(4(PHENYLCARBONYLCARBAMOTHIOYL)PIPERAZIN1YL)PYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
8ethyl5oxo2(4((phenylcarbonyl)carbamothioyl)piperazin1yl)58dihydropyrido(23d)pyrimidine6carboxylicacid
CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC(=O)C4=CC=CC=C4)C(=O)O
InChI=1SC22H22N6O4Sc12261316(20(31)32)17(29)15122321(2418(15)26)2781028(11927)22(33)2519(30)146435714h371213H2811H21H3(H3132)(H253033)
MFCD01994190
ZINC000002321430
ZINC2321430
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