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ethyl (2E)-5-(4-tert-butylphenyl)-7-methyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK794287
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)(C)C)c(=O)/c(=C\c1ccc(o1)c1ccccc1[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 C31H29N3O6S MW 571.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O6S/c1-6-39-29(36)26-18(2)32-30-33(27(26)19-11-13-20(14-12-19)31(3,4)5)28(35)25(41-30)17-21-15-16-24(40-21)22-9-7-8-10-23(22)34(37)38/h7-17,27H,6H2,1-5H3/b25-17+
InChIKey
GBHQVSUWGZIPLU-KOEQRZSOSA-N
Synonyms

(E)ethyl5(4(tertbutyl)phenyl)7methyl2((5(2nitrophenyl)furan2yl)methylene)3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)(C)C)c(=O)c(=Cc1ccc(o1)c1ccccc1(N+)(=O)(O))s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)(C)C)C(=O)C(=CC4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O))S2)C
ethyl(2E)5(4tertbutylphenyl)7methyl2((5(2nitrophenyl)furan2yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4tertbutylphenyl)7methyl2((5(2nitrophenyl)furan2yl)methylidene)3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC31H29N3O6Sc163929(36)2618(2)323033(27(26)19111320(141219)31(34)5)28(35)25(4130)1721151624(4021)229781023(22)34(37)38h71727H6H215H3b2517+
MFCD01956573
ZINC000102788758
ZINC000102788761

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Available files

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