Vitas-M small molecule compound

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

Catalog ID
STK833696
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C\c1ccc(o1)c1ccccc1Cl)/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 C27H21ClN2O4S MW 504.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClN2O4S/c1-3-33-26(32)23-16(2)29-27-30(24(23)17-9-5-4-6-10-17)25(31)22(35-27)15-18-13-14-21(34-18)19-11-7-8-12-20(19)28/h4-15,24H,3H2,1-2H3/b22-15+
InChIKey
CSMISFNNSNRIAU-PXLXIMEGSA-N
Synonyms
313966-41-5
(E)ethyl2((5(2chlorophenyl)furan2yl)methylene)7methyl3oxo5phenyl35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
313966415
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(o1)c1ccccc1Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC=C(O4)C5=CC=CC=C5Cl)S2)C
ethyl(2E)2((5(2chlorophenyl)furan2yl)methylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2((5(2CHLOROPHENYL)FURAN2YL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2((5(2CHLOROPHENYL)2FURYL)METHYLENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H21ClN2O4Sc133326(32)2316(2)292730(24(23)1795461017)25(31)22(3527)1518131421(3418)1911781220(19)28h41524H3H212H3b2215+
MFCD01072354
ZINC000008396014
ZINC000008396017

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Available files

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