Vitas-M small molecule compound
ethyl (2Z)-2-[4-(benzyloxy)benzylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK796791
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1ccc(cc1)OCc1ccccc1)/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 C31H28N2O5S MW 540.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O5S/c1-4-37-30(35)27-20(2)32-31-33(28(27)23-12-16-24(36-3)17-13-23)29(34)26(39-31)18-21-10-14-25(15-11-21)38-19-22-8-6-5-7-9-22/h5-18,28H,4,19H2,1-3H3/b26-18-InChIKey
CKHXFLLWASOIBH-ITYLOYPMSA-NSynonyms
(Z)ethyl2(4(benzyloxy)benzylidene)5(4methoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(cc1)OCc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=CC=C(C=C4)OCC5=CC=CC=C5)S2)C
ethyl(2Z)2(4(benzyloxy)benzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4METHOXYPHENYL)7METHYL3OXO2((4PHENYLMETHOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H28N2O5Sc143730(35)2720(2)323133(28(27)23121624(363)171323)29(34)26(3931)1821101425(151121)3819228657922h51828H419H213H3b2618
MFCD01532053
ZINC000002291576
ZINC000002291578
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