Vitas-M small molecule compound
ethyl (2E)-5-(2-methoxyphenyl)-7-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL412296
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)/c(=C\c1ccncc1)/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 C23H21N3O4S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4S/c1-4-30-22(28)19-14(2)25-23-26(20(19)16-7-5-6-8-17(16)29-3)21(27)18(31-23)13-15-9-11-24-12-10-15/h5-13,20H,4H2,1-3H3/b18-13+InChIKey
RLUVCVKYRFJPNQ-QGOAFFKASA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)c(=Cc1ccncc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3OC)C(=O)C(=CC4=CC=NC=C4)S2)C
ethyl(2E)5(2methoxyphenyl)7methyl3oxo2(pyridin4ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(2methoxyphenyl)7methyl3oxo2(pyridin4ylmethylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC23H21N3O4Sc143022(28)1914(2)252326(20(19)16756817(16)293)21(27)18(3123)131591124121015h51320H4H213H3b1813+
MFCD01801478
ZINC000006354042
ZINC000006354046
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