Vitas-M small molecule compound
2-[(2-methoxy-4-{(E)-[3-(4-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)methyl]benzonitrile
Catalog ID
STL358011
SMILES COc1cc(ccc1OCc1ccccc1C#N)/C=C\1/SC(=O)N(C1=O)Cc1ccc(cc1)[N+](=O)[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 C26H19N3O6S MW 501.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O6S/c1-34-23-12-18(8-11-22(23)35-16-20-5-3-2-4-19(20)14-27)13-24-25(30)28(26(31)36-24)15-17-6-9-21(10-7-17)29(32)33/h2-13H,15-16H2,1H3/b24-13+InChIKey
JDBAYONSZDHECK-ZMOGYAJESA-NSynonyms
2((2METHOXY4((E)(3((4NITROPHENYL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)METHYL)BENZONITRILE
2((2methoxy4((E)(3(4nitrobenzyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)methyl)benzonitrile
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)(N+)(=O)(O))OCC4=CC=CC=C4C#N
COc1cc(ccc1OCc1ccccc1C#N)C=C1SC(=O)N(C1=O)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC26H19N3O6Sc134231218(81122(23)351620532419(20)1427)132425(30)28(26(31)3624)15176921(10717)29(32)33h213H1516H21H3b2413+
MFCD04085468
ZINC000009232794
ZINC09232794
ZINC9232794
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