Vitas-M small molecule compound
2-({2-methoxy-4-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenoxy}methyl)benzonitrile
Catalog ID
STL416836
SMILES COc1cc(ccc1OCc1ccccc1C#N)/C=c/1\sc2n(c1=O)c1c(n2)cccc1
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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 C25H17N3O3S MW 439.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N3O3S/c1-30-22-12-16(10-11-21(22)31-15-18-7-3-2-6-17(18)14-26)13-23-24(29)28-20-9-5-4-8-19(20)27-25(28)32-23/h2-13H,15H2,1H3/b23-13-InChIKey
WVWAZIHVNQLQCF-QRVIBDJDSA-NSynonyms
2((2METHOXY4((Z)(1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)METHYL)PHENOXY)METHYL)BENZONITRILE
2((2methoxy4((Z)(3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)methyl)phenoxy)methyl)benzonitrile
COC1=C(C=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)OCC5=CC=CC=C5C#N
COc1cc(ccc1OCc1ccccc1C#N)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC25H17N3O3Sc130221216(101121(22)311518732617(18)1426)132324(29)2820954819(20)2725(28)3223h213H15H21H3b2313
MFCD03239612
ZINC000016214893
ZINC16214893
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