Vitas-M small molecule compound

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

Catalog ID
STL296374
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1ccc(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 C25H23N3O7S MW 509.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O7S/c1-5-35-24(30)21-14(2)26-25-27(22(21)16-8-11-18(33-3)19(13-16)34-4)23(29)20(36-25)12-15-6-9-17(10-7-15)28(31)32/h6-13,22H,5H2,1-4H3/b20-12-
InChIKey
VVOTXFQKMMMIHK-NDENLUEZSA-N
Synonyms
300723-34-6
(Z)ethyl5(34dimethoxyphenyl)7methyl2(4nitrobenzylidene)3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
300723346
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1ccc(cc1)(N+)(=O)(O))s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=CC=C(C=C4)(N+)(=O)(O))S2)C
ETHYL(2Z)5(34DIMETHOXYPHENYL)7METHYL2((4NITROPHENYL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(34dimethoxyphenyl)7methyl2(4nitrobenzylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H23N3O7Sc153524(30)2114(2)262527(22(21)1681118(333)19(1316)344)23(29)20(3625)12156917(10715)28(31)32h61322H5H214H3b2012
MFCD01931136
ZINC000002236685
ZINC000002236688

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Available files

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