Vitas-M small molecule compound

ethyl (2Z)-2-(4-methoxy-3-nitrobenzylidene)-7-methyl-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL484824
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1ccc(c(c1)[N+](=O)[O-])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 C25H23N3O6S MW 493.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O6S/c1-5-34-24(30)21-15(3)26-25-27(22(21)17-9-6-14(2)7-10-17)23(29)20(35-25)13-16-8-11-19(33-4)18(12-16)28(31)32/h6-13,22H,5H2,1-4H3/b20-13-
InChIKey
CYUVWXDTIBAATP-MOSHPQCFSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)c(=Cc1ccc(c(c1)(N+)(=O)(O))OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CC(=C(C=C4)OC)(N+)(=O)(O))S2)C
ETHYL(2Z)2((4METHOXY3NITROPHENYL)METHYLIDENE)7METHYL5(4METHYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(4methoxy3nitrobenzylidene)7methyl5(4methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H23N3O6Sc153424(30)2115(3)262527(22(21)179614(2)71017)23(29)20(3525)131681119(334)18(1216)28(31)32h61322H5H214H3b2013
MFCD01140782
ZINC000002918903
ZINC000002918907

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Available files

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