Vitas-M small molecule compound
(2E)-5-(3,4-dimethoxyphenyl)-2-(4-fluorobenzylidene)-7-methyl-N-(2-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL438402
SMILES COc1cc(ccc1OC)C1C(=C(C)N=c2n1c(=O)/c(=C\c1ccc(cc1)F)/s2)C(=O)Nc1ccccc1C
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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 C30H26FN3O4S MW 543.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26FN3O4S/c1-17-7-5-6-8-22(17)33-28(35)26-18(2)32-30-34(27(26)20-11-14-23(37-3)24(16-20)38-4)29(36)25(39-30)15-19-9-12-21(31)13-10-19/h5-16,27H,1-4H3,(H,33,35)/b25-15+InChIKey
YAOSDKIRSGJRPU-MFKUBSTISA-NSynonyms
(2E)5(34dimethoxyphenyl)2((4fluorophenyl)methylidene)7methylN(2methylphenyl)3oxo5H(13)thiazolo(32a)pyrimidine6carboxamide
(2E)5(34dimethoxyphenyl)2(4fluorobenzylidene)7methylN(2methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
CC1=CC=CC=C1NC(=O)C2=C(N=C3N(C2C4=CC(=C(C=C4)OC)OC)C(=O)C(=CC5=CC=C(C=C5)F)S3)C
COc1cc(ccc1OC)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccc(cc1)F)s2)C(=O)Nc1ccccc1C
InChI=1SC30H26FN3O4Sc117756822(17)3328(35)2618(2)323034(27(26)20111423(373)24(1620)384)29(36)25(3930)151991221(31)131019h51627H14H3(H3335)b2515+
MFCD06242101
ZINC000008711277
ZINC000101388949
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