Vitas-M small molecule compound
ethyl (2Z)-5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2-(3-phenoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK794245
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C/c1cccc(c1)Oc1ccccc1)/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 C31H26N2O6S MW 554.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2O6S/c1-4-37-30(36)27-19(2)32-31-33(28(27)22-13-15-24(16-14-22)38-20(3)34)29(35)26(40-31)18-21-9-8-12-25(17-21)39-23-10-6-5-7-11-23/h5-18,28H,4H2,1-3H3/b26-18-InChIKey
FSCYPHYXKKLAOY-ITYLOYPMSA-NSynonyms
(E)ethyl5(4acetoxyphenyl)7methyl3oxo2(3phenoxybenzylidene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=Cc1cccc(c1)Oc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC(=O)C)C(=O)C(=CC4=CC(=CC=C4)OC5=CC=CC=C5)S2)C
ethyl(2Z)5(4(acetyloxy)phenyl)7methyl3oxo2(3phenoxybenzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ACETYLOXYPHENYL)7METHYL3OXO2((3PHENOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H26N2O6Sc143730(36)2719(2)323133(28(27)22131524(161422)3820(3)34)29(35)26(4031)1821981225(1721)3923106571123h51828H4H213H3b2618
MFCD13372473
ZINC000001790938
ZINC000001790942
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