Vitas-M small molecule compound

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

Catalog ID
STK798829
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)C)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 C35H30N4O4S MW 602.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30N4O4S/c1-5-19-43-34(41)30-23(3)36-35-39(32(30)25-15-17-28(42-4)18-16-25)33(40)29(44-35)20-26-21-38(27-9-7-6-8-10-27)37-31(26)24-13-11-22(2)12-14-24/h5-18,20-21,32H,1,19H2,2-4H3/b29-20-
InChIKey
FDIHEDDXOLHKTD-BRPDVVIDSA-N
Synonyms

C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1)s2
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC=C)C5=CC=C(C=C5)OC)C6=CC=CC=C6
InChI=1SC35H30N4O4Sc15194334(41)3023(3)363539(32(30)25151728(424)181625)33(40)29(4435)20262138(2797681027)3731(26)24131122(2)121424h518202132H119H224H3b2920
MFCD03462096
prop2en1yl(2Z)5(4methoxyphenyl)7methyl2((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)5(4METHOXYPHENYL)7METHYL2((3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000097946190
ZINC000097946191

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Available files

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