Vitas-M small molecule compound
ethyl (2Z)-5-[4-(dimethylamino)phenyl]-7-methyl-2-{4-[(4-nitrobenzyl)oxy]benzylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK103790
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C/c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])/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 C32H30N4O6S MW 598.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N4O6S/c1-5-41-31(38)28-20(2)33-32-35(29(28)23-10-14-24(15-11-23)34(3)4)30(37)27(43-32)18-21-8-16-26(17-9-21)42-19-22-6-12-25(13-7-22)36(39)40/h6-18,29H,5,19H2,1-4H3/b27-18-InChIKey
XDONUGPBVIBCDZ-IMRQLAEWSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1ccc(cc1)OCc1ccc(cc1)(N+)(=O)(O))s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC=C(C=C4)OCC5=CC=C(C=C5)(N+)(=O)(O))S2)C
ethyl(2Z)5(4(dimethylamino)phenyl)7methyl2((4((4nitrophenyl)methoxy)phenyl)methylidene)3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4(DIMETHYLAMINO)PHENYL)7METHYL2(4((4NITROBENZYL)OXY)BENZYLIDENE)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)5(4DIMETHYLAMINOPHENYL)7METHYL2((4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H30N4O6Sc154131(38)2820(2)333235(29(28)23101424(151123)34(3)4)30(37)27(4332)182181626(17921)42192261225(13722)36(39)40h61829H519H214H3b2718
MFCD01592920
ZINC000100533476
ZINC000100533478
Check stock
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