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ethyl (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-7-methyl-5-(3-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK833753
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)[N+](=O)[O-])c(=O)/c(=C\c1ccc3c(c1)OCO3)/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 C24H19N3O7S MW 493.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O7S/c1-3-32-23(29)20-13(2)25-24-26(21(20)15-5-4-6-16(11-15)27(30)31)22(28)19(35-24)10-14-7-8-17-18(9-14)34-12-33-17/h4-11,21H,3,12H2,1-2H3/b19-10+
InChIKey
AMVUVURXYZECEP-VXLYETTFSA-N
Synonyms
313966-38-0
(E)ethyl2(benzo(d)(13)dioxol5ylmethylene)7methyl5(3nitrophenyl)3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
313966380
CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)(N+)(=O)(O))c(=O)c(=Cc1ccc3c(c1)OCO3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C(=CC4=CC5=C(C=C4)OCO5)S2)C
ethyl(2E)2(13benzodioxol5ylmethylidene)7methyl5(3nitrophenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2(13BENZODIOXOL5YLMETHYLIDENE)7METHYL5(3NITROPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2(13BENZODIOXOL5YLMETHYLENE)5(3NITROPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2(2H13BENZODIOXOL5YLMETHYLIDENE)7METHYL5(3NITROPHENYL)3OXO2H3H5HPYRIMIDO(21B)(13)THIAZOLE6CARBOXYLATE
ETHYL2(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)7METHYL5(3NITROPHENYL)3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC24H19N3O7Sc133223(29)2013(2)252426(21(20)1554616(1115)27(30)31)22(28)19(3524)1014781718(914)34123317h41121H312H212H3b1910+
MFCD00845301
ZINC000008397759
ZINC000008397763

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Available files

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