Vitas-M small molecule compound

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

Catalog ID
STK698399
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cc(OC)ccc1OC)c(=O)/c(=C/c1ccc(cc1)SC)/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 C26H26N2O5S2 MW 510.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O5S2/c1-6-33-25(30)22-15(2)27-26-28(23(22)19-14-17(31-3)9-12-20(19)32-4)24(29)21(35-26)13-16-7-10-18(34-5)11-8-16/h7-14,23H,6H2,1-5H3/b21-13-
InChIKey
ILPRIKGUYOUMGN-BKUYFWCQSA-N
Synonyms
292870-87-2
(Z)ethyl5(25dimethoxyphenyl)7methyl2(4(methylthio)benzylidene)3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
292870872
CCOC(=O)C1=C(C)N=c2n(C1c1cc(OC)ccc1OC)c(=O)c(=Cc1ccc(cc1)SC)s2
CCOC(=O)C1=C(N=C2N(C1C3=C(C=CC(=C3)OC)OC)C(=O)C(=CC4=CC=C(C=C4)SC)S2)C
ETHYL(2Z)5(25DIMETHOXYPHENYL)7METHYL2((4METHYLSULFANYLPHENYL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(25dimethoxyphenyl)7methyl2(4(methylsulfanyl)benzylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC26H26N2O5S2c163325(30)2215(2)272628(23(22)191417(313)91220(19)324)24(29)21(3526)131671018(345)11816h71423H6H215H3b2113
MFCD01592089
ZINC000002302026
ZINC000002302028

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Available files

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