Vitas-M small molecule compound
ethyl (2Z)-7-methyl-2-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK676188
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1ccc(o1)c1ccc(cc1[N+](=O)[O-])C)/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 C29H25N3O6S MW 543.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O6S/c1-5-37-28(34)25-18(4)30-29-31(26(25)19-9-6-16(2)7-10-19)27(33)24(39-29)15-20-11-13-23(38-20)21-12-8-17(3)14-22(21)32(35)36/h6-15,26H,5H2,1-4H3/b24-15-InChIKey
LEXLRDWBCJAQFH-IWIPYMOSSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)c(=Cc1ccc(o1)c1ccc(cc1(N+)(=O)(O))C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CC=C(O4)C5=C(C=C(C=C5)C)(N+)(=O)(O))S2)C
ethyl(2Z)7methyl2((5(4methyl2nitrophenyl)furan2yl)methylidene)5(4methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)7METHYL2((5(4METHYL2NITROPHENYL)FURAN2YL)METHYLIDENE)5(4METHYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H25N3O6Sc153728(34)2518(4)302931(26(25)199616(2)71019)27(33)24(3929)1520111323(3820)2112817(3)1422(21)32(35)36h61526H5H214H3b2415
MFCD01140745
ZINC000002920255
ZINC000002920260
Check stock
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Check stock on Vitas-MAvailable files
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