Vitas-M small molecule compound

prop-2-en-1-yl (2Z)-5-(4-methoxyphenyl)-2-{[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK798822
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)OC)c1ccccc1)/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 C35H30N4O5S MW 618.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30N4O5S/c1-5-19-44-34(41)30-22(2)36-35-39(32(30)24-13-17-28(43-4)18-14-24)33(40)29(45-35)20-25-21-38(26-9-7-6-8-10-26)37-31(25)23-11-15-27(42-3)16-12-23/h5-18,20-21,32H,1,19H2,2-4H3/b29-20-
InChIKey
LPGANLUIQOSREO-BRPDVVIDSA-N
Synonyms

C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1cn(nc1c1ccc(cc1)OC)c1ccccc1)s2
CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5)SC2=N1)C6=CC=C(C=C6)OC)C(=O)OCC=C
InChI=1SC35H30N4O5Sc15194434(41)3022(2)363539(32(30)24131728(434)181424)33(40)29(4535)20252138(2697681026)3731(25)23111527(423)161223h518202132H119H224H3b2920
MFCD03462089
prop2en1yl(2Z)5(4methoxyphenyl)2((3(4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)5(4METHOXYPHENYL)2((3(4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000097946184
ZINC000097946185

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Available files

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