Vitas-M small molecule compound
ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[4-(diethylamino)-2-methoxybenzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL506606
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C/c1ccc(cc1OC)N(CC)CC)/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 C29H31N3O6S MW 549.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O6S/c1-6-31(7-2)20-11-9-18(22(15-20)35-5)14-24-27(33)32-26(19-10-12-21-23(13-19)38-16-37-21)25(28(34)36-8-3)17(4)30-29(32)39-24/h9-15,26H,6-8,16H2,1-5H3/b24-14-InChIKey
GFZAGALBJGOBJN-OYKKKHCWSA-NSynonyms
5724855
ethyl(2~(Z))5(13benzodioxol5yl)2((4(diethylamino)2methoxyphenyl)methylidene)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(13BENZODIOXOL5YL)2((4(DIETHYLAMINO)2METHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(13benzodioxol5yl)2(4(diethylamino)2methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL5(13BENZODIOXOL5YL)2(4(DIETHYLAMINO)2METHOXYBENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H31N3O6Sc1631(72)2011918(22(1520)355)142427(33)3226(1910122123(1319)38163721)25(28(34)3683)17(4)3029(32)3924h91526H6816H215H3b2414
MFCD01242072
ZINC000000653618
ZINC000000653619
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