Vitas-M small molecule compound
ethyl (2Z)-2-[3-methoxy-4-(pentyloxy)benzylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798153
SMILES CCCCCOc1ccc(cc1OC)/C=c/1\sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)OCC)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 C27H30N2O5S2 MW 526.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O5S2/c1-5-7-8-13-34-19-12-11-18(15-20(19)32-4)16-22-25(30)29-24(21-10-9-14-35-21)23(26(31)33-6-2)17(3)28-27(29)36-22/h9-12,14-16,24H,5-8,13H2,1-4H3/b22-16-InChIKey
NGRQPFNTWRWUSW-JWGURIENSA-NSynonyms
CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=CS4)OC
CCCCCOc1ccc(cc1OC)C=c1sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)OCC)C
ETHYL(2Z)2((3METHOXY4PENTOXYPHENYL)METHYLIDENE)7METHYL3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3methoxy4(pentyloxy)benzylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC27H30N2O5S2c1578133419121118(1520(19)324)162225(30)2924(21109143521)23(26(31)3362)17(3)2827(29)3622h912141624H5813H214H3b2216
MFCD03461877
ZINC000016700164
ZINC000016700166
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