Vitas-M small molecule compound

ethyl (2Z)-2-(anthracen-9-ylmethylidene)-5-(3-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK362045
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)OC)c(=O)/c(=C/c1c3ccccc3cc3c1cccc3)/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 C32H26N2O4S MW 534.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26N2O4S/c1-4-38-31(36)28-19(2)33-32-34(29(28)22-12-9-13-23(17-22)37-3)30(35)27(39-32)18-26-24-14-7-5-10-20(24)16-21-11-6-8-15-25(21)26/h5-18,29H,4H2,1-3H3/b27-18-
InChIKey
MQCYLVRRGGEEJH-IMRQLAEWSA-N
Synonyms

(Z)ethyl2(anthracen9ylmethylene)5(3methoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)OC)c(=O)c(=Cc1c3ccccc3cc3c1cccc3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=CC=C3)OC)C(=O)C(=CC4=C5C=CC=CC5=CC6=CC=CC=C64)S2)C
ETHYL(2Z)2(ANTHRACEN9YLMETHYLIDENE)5(3METHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(ANTHRACEN9YLMETHYLIDENE)5(3METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H26N2O4Sc143831(36)2819(2)333234(29(28)221291323(1722)373)30(35)27(3932)18262414751020(24)162111681525(21)26h51829H4H213H3b2718
MFCD02109405
ZINC000002248360
ZINC000002248362

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.