Vitas-M small molecule compound
(2Z)-6-acetyl-2-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
Catalog ID
STL506618
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccc(o1)c1cc(ccc1Cl)[N+](=O)[O-])/s2)C(=O)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 C27H20ClN3O6S MW 549.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN3O6S/c1-14-24(15(2)32)25(16-4-7-18(36-3)8-5-16)30-26(33)23(38-27(30)29-14)13-19-9-11-22(37-19)20-12-17(31(34)35)6-10-21(20)28/h4-13,25H,1-3H3/b23-13-InChIKey
YHSOFCFXXLXYFF-QRVIBDJDSA-NSynonyms
(2~(Z))6acetyl2((5(2chloro5nitrophenyl)furan2yl)methylidene)5(4methoxyphenyl)7methyl5~(H)(13)thiazolo(32a)pyrimidin3one
(2Z)6acetyl2((5(2chloro5nitrophenyl)furan2yl)methylidene)5(4methoxyphenyl)7methyl5H(13)thiazolo(32a)pyrimidin3(2H)one
21209104
InChI=1SC27H20ClN3O6Sc11424(15(2)32)25(164718(363)8516)3026(33)23(3827(30)2914)131991122(3719)201217(31(34)35)61021(20)28h41325H13H3b2313
MFCD02378808
ZINC000111474581
ZINC000111474584
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