Vitas-M small molecule compound
prop-2-en-1-yl 2-[3-(1,3-benzothiazol-2-ylcarbonyl)-4-hydroxy-5-oxo-2-phenyl-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK883228
SMILES C=CCOC(=O)c1sc(nc1C)N1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1nc2c(s1)cccc2
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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 C26H19N3O5S2 MW 517.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O5S2/c1-3-13-34-25(33)22-14(2)27-26(36-22)29-19(15-9-5-4-6-10-15)18(21(31)24(29)32)20(30)23-28-16-11-7-8-12-17(16)35-23/h3-12,19,31H,1,13H2,2H3InChIKey
SRVGYQRMKLKEAP-UHFFFAOYSA-NSynonyms
CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5)C(=O)OCC=C
InChI=1SC26H19N3O5S2c13133425(33)2214(2)2726(3622)2919(1595461015)18(21(31)24(29)32)20(30)23281611781217(16)3523h3121931H113H22H3
MFCD06646744
prop2en1yl2(3(13benzothiazol2ylcarbonyl)4hydroxy5oxo2phenyl25dihydro1Hpyrrol1yl)4methyl13thiazole5carboxylate
prop2enyl2(3(13benzothiazole2carbonyl)4hydroxy5oxo2phenyl2Hpyrrol1yl)4methyl13thiazole5carboxylate
ZINC000016750584
ZINC000016750585
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