Vitas-M small molecule compound
ethyl (2Z)-2-[4-(dimethylamino)benzylidene]-7-methyl-3-oxo-5-[4-(prop-2-en-1-yloxy)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL506262
SMILES C=CCOc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccc(cc1)N(C)C)/s2)C(=O)OCC
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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 C28H29N3O4S MW 503.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S/c1-6-16-35-22-14-10-20(11-15-22)25-24(27(33)34-7-2)18(3)29-28-31(25)26(32)23(36-28)17-19-8-12-21(13-9-19)30(4)5/h6,8-15,17,25H,1,7,16H2,2-5H3/b23-17-InChIKey
JEXLIKRPQFAOFB-QJOMJCCJSA-NSynonyms
6154635
ethyl(2~(Z))2((4(dimethylamino)phenyl)methylidene)7methyl3oxo5(4prop2enoxyphenyl)5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((4DIMETHYLAMINOPHENYL)METHYLIDENE)7METHYL3OXO5(4PROP2ENOXYPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(4(dimethylamino)benzylidene)7methyl3oxo5(4(prop2en1yloxy)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC28H29N3O4Sc16163522141020(111522)2524(27(33)3472)18(3)292831(25)26(32)23(3628)171981221(13919)30(4)5h68151725H1716H225H3b2317
MFCD04083570
ZINC000022827340
ZINC000022827344
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