Vitas-M small molecule compound
methyl 4-[(3E)-3-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-4,5-dioxo-1-(1,3-thiazol-2-yl)pyrrolidin-2-yl]benzoate
Catalog ID
STK567823
SMILES COC(=O)c1ccc(cc1)C1N(c2nccs2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/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 C30H24N2O6S MW 540.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O6S/c1-18-4-3-5-19(16-18)17-38-23-12-10-21(11-13-23)26(33)24-25(20-6-8-22(9-7-20)29(36)37-2)32(28(35)27(24)34)30-31-14-15-39-30/h3-16,25,33H,17H2,1-2H3/b26-24+InChIKey
DIWBEPQVJVMZCY-SHHOIMCASA-NSynonyms
836624-32-9836624329
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)C4=NC=CS4)C5=CC=C(C=C5)C(=O)OC)O
COC(=O)c1ccc(cc1)C1N(c2nccs2)C(=O)C(=O)C1=C(c1ccc(cc1)OCc1cccc(c1)C)O
InChI=1SC30H24N2O6Sc11843519(1618)173823121021(111323)26(33)2425(206822(9720)29(36)372)32(28(35)27(24)34)303114153930h3162533H17H212H3b2624+
methyl4((3E)3(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)45dioxo1(13thiazol2yl)pyrrolidin2yl)benzoate
METHYL4((3E)3(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)45DIOXO1(13THIAZOL2YL)PYRROLIDIN2YL)BENZOATE
MFCD05731518
ZINC000102549464
ZINC000102549473
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