Vitas-M small molecule compound
ethyl (2Z)-5-(2-methoxyphenyl)-7-methyl-2-{[5-(morpholin-4-yl)furan-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL164246
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)/c(=C/c1ccc(o1)N1CCOCC1)/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 C26H27N3O6S MW 509.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6S/c1-4-34-25(31)22-16(2)27-26-29(23(22)18-7-5-6-8-19(18)32-3)24(30)20(36-26)15-17-9-10-21(35-17)28-11-13-33-14-12-28/h5-10,15,23H,4,11-14H2,1-3H3/b20-15-InChIKey
XAGCJEMXPIBHOH-HKWRFOASSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)c(=Cc1ccc(o1)N1CCOCC1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3OC)C(=O)C(=CC4=CC=C(O4)N5CCOCC5)S2)C
ethyl(2Z)5(2methoxyphenyl)7methyl2((5(morpholin4yl)furan2yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(2methoxyphenyl)7methyl2((5morpholin4ylfuran2yl)methylidene)3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC26H27N3O6Sc143425(31)2216(2)272629(23(22)18756819(18)323)24(30)20(3626)151791021(3517)28111333141228h5101523H41114H213H3b2015
MFCD20731796
ZINC000000680801
ZINC000000680803
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