Vitas-M small molecule compound
ethyl (2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-5-(4-methoxyphenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522675
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1ccc3c(c1)OCO3)/s2)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 C30H24N2O6S MW 540.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O6S/c1-3-36-29(34)25-26(19-7-5-4-6-8-19)31-30-32(27(25)20-10-12-21(35-2)13-11-20)28(33)24(39-30)16-18-9-14-22-23(15-18)38-17-37-22/h4-16,27H,3,17H2,1-2H3/b24-16-InChIKey
QLBJIOUCDVEMPM-JLPGSUDCSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc3c(c1)OCO3)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=CC5=C(C=C4)OCO5)S2)C6=CC=CC=C6
ethyl(2Z)2(13benzodioxol5ylmethylidene)5(4methoxyphenyl)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(13BENZODIOXOL5YLMETHYLIDENE)5(4METHOXYPHENYL)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H24N2O6Sc133629(34)2526(197546819)313032(27(25)20101221(352)131120)28(33)24(3930)16189142223(1518)38173722h41627H317H212H3b2416
MFCD01820995
ZINC000003669870
ZINC000003669872
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