Vitas-M small molecule compound
propan-2-yl (2Z)-2-(2-hydroxy-3-nitrobenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL506637
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1cccc(c1O)[N+](=O)[O-])/s2)C(=O)OC(C)C
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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 C25H23N3O7S MW 509.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O7S/c1-13(2)35-24(31)20-14(3)26-25-27(21(20)15-8-10-17(34-4)11-9-15)23(30)19(36-25)12-16-6-5-7-18(22(16)29)28(32)33/h5-13,21,29H,1-4H3/b19-12-InChIKey
SMMOWCXYFPFOHB-UNOMPAQXSA-NSynonyms
6172736
InChI=1SC25H23N3O7Sc113(2)3524(31)2014(3)262527(21(20)1581017(344)11915)23(30)19(3625)121665718(22(16)29)28(32)33h5132129H14H3b1912
MFCD02632183
propan2yl(2~(Z))2((2hydroxy3nitrophenyl)methylidene)5(4methoxyphenyl)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
PROPAN2YL(2Z)2((2HYDROXY3NITROPHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
propan2yl(2Z)2(2hydroxy3nitrobenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000002139490
ZINC000002139495
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