Vitas-M small molecule compound

ethyl (2Z)-5-(2-bromo-4,5-dimethoxyphenyl)-2-{[5-(diethylamino)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL164254
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cc(OC)c(cc1Br)OC)c(=O)/c(=C/c1ccc(o1)N(CC)CC)/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 C27H30BrN3O6S MW 604.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30BrN3O6S/c1-7-30(8-2)22-11-10-16(37-22)12-21-25(32)31-24(17-13-19(34-5)20(35-6)14-18(17)28)23(26(33)36-9-3)15(4)29-27(31)38-21/h10-14,24H,7-9H2,1-6H3/b21-12-
InChIKey
DLXLQFIEZDYTPS-MTJSOVHGSA-N
Synonyms

CCN(CC)C1=CC=C(O1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC(=C(C=C4Br)OC)OC
CCOC(=O)C1=C(C)N=c2n(C1c1cc(OC)c(cc1Br)OC)c(=O)c(=Cc1ccc(o1)N(CC)CC)s2
ethyl(2Z)5(2bromo45dimethoxyphenyl)2((5(diethylamino)furan2yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(2BROMO45DIMETHOXYPHENYL)2((5(DIETHYLAMINO)FURAN2YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H30BrN3O6Sc1730(82)22111016(3722)122125(32)3124(171319(345)20(356)1418(17)28)23(26(33)3693)15(4)2927(31)3821h101424H79H216H3b2112
MFCD02632147
ZINC000097971059
ZINC000097971060

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Available files

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