Vitas-M small molecule compound
methyl 4-[(3E)-3-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Catalog ID
STK594388
SMILES COC(=O)c1ccc(cc1)C1N(c2nnc(s2)C)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 C30H25N3O6S MW 555.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N3O6S/c1-17-5-4-6-19(15-17)16-39-23-13-11-21(12-14-23)26(34)24-25(20-7-9-22(10-8-20)29(37)38-3)33(28(36)27(24)35)30-32-31-18(2)40-30/h4-15,25,34H,16H2,1-3H3/b26-24+InChIKey
BEAOMPVNQLYSQI-SHHOIMCASA-NSynonyms
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)C4=NN=C(S4)C)C5=CC=C(C=C5)C(=O)OC)O
COC(=O)c1ccc(cc1)C1N(c2nnc(s2)C)C(=O)C(=O)C1=C(c1ccc(cc1)OCc1cccc(c1)C)O
InChI=1SC30H25N3O6Sc11754619(1517)163923131121(121423)26(34)2425(207922(10820)29(37)383)33(28(36)27(24)35)30323118(2)4030h4152534H16H213H3b2624+
methyl4((3E)3(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)1(5methyl134thiadiazol2yl)45dioxopyrrolidin2yl)benzoate
methyl4((3E)3(hydroxy(4((3methylphenyl)methoxy)phenyl)methylidene)1(5methyl134thiadiazol2yl)45dioxopyrrolidin2yl)benzoate
MFCD07201019
ZINC000102614855
ZINC000102614862
Check stock
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