Vitas-M small molecule compound
prop-2-en-1-yl 2-[2-(4-tert-butylphenyl)-4-hydroxy-5-oxo-3-(thiophen-2-ylcarbonyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK897142
SMILES C=CCOC(=O)c1sc(nc1C)N1C(=O)C(=C(C1c1ccc(cc1)C(C)(C)C)C(=O)c1cccs1)O
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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 C27H26N2O5S2 MW 522.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5S2/c1-6-13-34-25(33)23-15(2)28-26(36-23)29-20(16-9-11-17(12-10-16)27(3,4)5)19(22(31)24(29)32)21(30)18-8-7-14-35-18/h6-12,14,20,31H,1,13H2,2-5H3InChIKey
SZARSLYGYBUVLZ-UHFFFAOYSA-NSynonyms
CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=C(C=C4)C(C)(C)C)C(=O)OCC=C
InChI=1SC27H26N2O5S2c16133425(33)2315(2)2826(3623)2920(1691117(121016)27(34)5)19(22(31)24(29)32)21(30)1887143518h612142031H113H225H3
MFCD03268750
prop2en1yl2(2(4tertbutylphenyl)4hydroxy5oxo3(thiophen2ylcarbonyl)25dihydro1Hpyrrol1yl)4methyl13thiazole5carboxylate
PROP2ENYL2(2(4TERTBUTYLPHENYL)4HYDROXY5OXO3(THIOPHENE2CARBONYL)2HPYRROL1YL)4METHYL13THIAZOLE5CARBOXYLATE
PROP2ENYL2(5(4(TERTBUTYL)PHENYL)3HYDROXY2OXO4(2THIENYLCARBONYL)(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
ZINC000008779313
ZINC000008779314
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