Vitas-M small molecule compound
ethyl (2E)-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2-(1H-pyrrol-2-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL177245
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C\c1ccc[nH]1)/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 C24H25N3O3S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3S/c1-5-30-23(29)20-15(4)26-24-27(21(20)17-10-8-16(9-11-17)14(2)3)22(28)19(31-24)13-18-7-6-12-25-18/h6-14,21,25H,5H2,1-4H3/b19-13+InChIKey
RWTASJSSVGFTPQ-CPNJWEJPSA-NSynonyms
832136-79-5832136795
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)c(=Cc1ccc(nH)1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=CN4)S2)C
ethyl(2E)7methyl3oxo5(4(propan2yl)phenyl)2(1Hpyrrol2ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)7methyl3oxo5(4propan2ylphenyl)2(1Hpyrrol2ylmethylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC24H25N3O3Sc153023(29)2015(4)262427(21(20)1710816(91117)14(2)3)22(28)19(3124)131876122518h6142125H5H214H3b1913+
MFCD04052467
ZINC000020608467
ZINC000032479655
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