Vitas-M small molecule compound
ethyl (2Z)-7-methyl-2-[2-(4-methylpiperazin-1-yl)-5-nitrobenzylidene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL506643
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1cc(ccc1N1CCN(CC1)C)[N+](=O)[O-])/s2
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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 C28H29N5O5S MW 547.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O5S/c1-4-38-27(35)24-18(2)29-28-32(25(24)19-8-6-5-7-9-19)26(34)23(39-28)17-20-16-21(33(36)37)10-11-22(20)31-14-12-30(3)13-15-31/h5-11,16-17,25H,4,12-15H2,1-3H3/b23-17-InChIKey
BUVZEDMCHLBEAV-QJOMJCCJSA-NSynonyms
6247756
ethyl(2~(Z))7methyl2((2(4methylpiperazin1yl)5nitrophenyl)methylidene)3oxo5phenyl5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)7METHYL2((2(4METHYLPIPERAZIN1YL)5NITROPHENYL)METHYLIDENE)3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)7methyl2(2(4methylpiperazin1yl)5nitrobenzylidene)3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC28H29N5O5Sc143827(35)2418(2)292832(25(24)198657919)26(34)23(3928)17201621(33(36)37)101122(20)31141230(3)131531h511161725H41215H213H3b2317
MFCD31614377
ZINC000002797262
ZINC000002797264
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