Vitas-M small molecule compound
9-benzyl-2-[(4-ethoxyphenyl)amino]-4-hydroxy-1,3,9-triazaspiro[5.5]undeca-1,3-diene-5-carbonitrile
Catalog ID
STK638939
SMILES CCOc1ccc(cc1)NC1=NC2(C(C(=N1)O)C#N)CCN(CC2)Cc1ccccc1
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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 C24H27N5O2 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O2/c1-2-31-20-10-8-19(9-11-20)26-23-27-22(30)21(16-25)24(28-23)12-14-29(15-13-24)17-18-6-4-3-5-7-18/h3-11,21H,2,12-15,17H2,1H3,(H2,26,27,28,30)InChIKey
QGGJSLVVDOFUTN-UHFFFAOYSA-NSynonyms
941236-44-8941236448
9benzyl2((4ethoxyphenyl)amino)4hydroxy139triazaspiro(55)undeca13diene5carbonitrile
9benzyl2(4ethoxyanilino)4oxo139triazaspiro(55)undec1ene5carbonitrile
CCOC1=CC=C(C=C1)NC2=NC3(CCN(CC3)CC4=CC=CC=C4)C(C(=O)N2)C#N
InChI=1SC24H27N5O2c12312010819(91120)26232722(30)21(1625)24(2823)121429(151324)17186435718h31121H2121517H21H3(H226272830)
MFCD18161839
ZINC000049769478
ZINC000049769479
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