Vitas-M small molecule compound
propan-2-yl (2Z)-2-(2-ethoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK796779
SMILES CCOc1ccccc1/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OC(C)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 C27H28N2O5S MW 492.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5S/c1-6-33-21-10-8-7-9-19(21)15-22-25(30)29-24(18-11-13-20(32-5)14-12-18)23(26(31)34-16(2)3)17(4)28-27(29)35-22/h7-16,24H,6H2,1-5H3/b22-15-InChIKey
OBXQDOLOHRXMAV-JCMHNJIXSA-NSynonyms
CCOC1=CC=CC=C1C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC(C)C)C4=CC=C(C=C4)OC
CCOc1ccccc1C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OC(C)C)C
InChI=1SC27H28N2O5Sc1633211087919(21)152225(30)2924(18111320(325)141218)23(26(31)3416(2)3)17(4)2827(29)3522h71624H6H215H3b2215
MFCD13372523
propan2yl(2Z)2((2ethoxyphenyl)methylidene)5(4methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
propan2yl(2Z)2(2ethoxybenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000039381484
ZINC000039381486
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