Vitas-M small molecule compound
2-({2-ethoxy-4-[(Z)-(1-ethyl-3-methyl-5-oxo-2-thioxoimidazolidin-4-ylidene)methyl]phenoxy}methyl)benzonitrile
Catalog ID
STL370144
SMILES CCOc1cc(ccc1OCc1ccccc1C#N)/C=C\1/C(=O)N(C(=S)N1C)CC
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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 C23H23N3O3S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S/c1-4-26-22(27)19(25(3)23(26)30)12-16-10-11-20(21(13-16)28-5-2)29-15-18-9-7-6-8-17(18)14-24/h6-13H,4-5,15H2,1-3H3/b19-12-InChIKey
NPRAKVMRPCDYEK-UNOMPAQXSA-NSynonyms
2((2ETHOXY4((Z)(1ETHYL3METHYL5OXO2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)METHYL)BENZONITRILE
2((2ethoxy4((Z)(1ethyl3methyl5oxo2thioxoimidazolidin4ylidene)methyl)phenoxy)methyl)benzonitrile
CCN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3C#N)OCC)N(C1=S)C
CCOc1cc(ccc1OCc1ccccc1C#N)C=C1C(=O)N(C(=S)N1C)CC
InChI=1SC23H23N3O3Sc142622(27)19(25(3)23(26)30)1216101120(21(1316)2852)291518976817(18)1424h613H4515H213H3b1912
MFCD05150027
ZINC000005509664
ZINC05509664
ZINC5509664
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