Vitas-M small molecule compound

ethyl (2Z)-2-[4-(benzyloxy)benzylidene]-5-[4-(dimethylamino)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK522609
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C/c1ccc(cc1)OCc1ccccc1)/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 C32H31N3O4S MW 553.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O4S/c1-5-38-31(37)28-21(2)33-32-35(29(28)24-13-15-25(16-14-24)34(3)4)30(36)27(40-32)19-22-11-17-26(18-12-22)39-20-23-9-7-6-8-10-23/h6-19,29H,5,20H2,1-4H3/b27-19-
InChIKey
NWDPSNJBWIEXRH-DIBXZPPDSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1ccc(cc1)OCc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC=C(C=C4)OCC5=CC=CC=C5)S2)C
ethyl(2Z)2(4(benzyloxy)benzylidene)5(4(dimethylamino)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(4(dimethylamino)phenyl)7methyl3oxo2((4phenylmethoxyphenyl)methylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4DIMETHYLAMINOPHENYL)7METHYL3OXO2((4PHENYLMETHOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H31N3O4Sc153831(37)2821(2)333235(29(28)24131525(161424)34(3)4)30(36)27(4032)1922111726(181222)39202397681023h61929H520H214H3b2719
MFCD01532544
ZINC000002187674
ZINC000002187676

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Available files

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