Vitas-M small molecule compound
ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-{4-methoxy-3-[(2-methylphenoxy)methyl]benzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL175974
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C\c1ccc(c(c1)COc1ccccc1C)OC)/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 C34H35N3O5S MW 597.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H35N3O5S/c1-7-41-33(39)30-22(3)35-34-37(31(30)24-13-15-26(16-14-24)36(4)5)32(38)29(43-34)19-23-12-17-28(40-6)25(18-23)20-42-27-11-9-8-10-21(27)2/h8-19,31H,7,20H2,1-6H3/b29-19+InChIKey
DXVMSHHNSQLDQP-VUTHCHCSSA-NSynonyms
512814-78-7512814787
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1ccc(c(c1)COc1ccccc1C)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC(=C(C=C4)OC)COC5=CC=CC=C5C)S2)C
ethyl(2E)5(4(dimethylamino)phenyl)2((4methoxy3((2methylphenoxy)methyl)phenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4(dimethylamino)phenyl)2(4methoxy3((2methylphenoxy)methyl)benzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL5(4(DIMETHYLAMINO)PHENYL)2(4METHOXY3((2METHYLPHENOXY)METHYL)BENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC34H35N3O5Sc174133(39)3022(3)353437(31(30)24131526(161424)36(4)5)32(38)29(4334)1923121728(406)25(1823)20422711981021(27)2h81931H720H216H3b2919+
MFCD03466973
ZINC000008450901
ZINC000008450902
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