Vitas-M small molecule compound
2-[(4-bromobenzyl)sulfanyl]-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
Catalog ID
STK761389
SMILES N#CC1=C(SCc2ccc(cc2)Br)NC(=O)C(C21CCCCC2)C#N
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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 C19H18BrN3OS MW 416.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN3OS/c20-14-6-4-13(5-7-14)12-25-18-16(11-22)19(8-2-1-3-9-19)15(10-21)17(24)23-18/h4-7,15H,1-3,8-9,12H2,(H,23,24)InChIKey
BULJGMVMRBYPEX-UHFFFAOYSA-NSynonyms
309278-43-110((4BROMOPHENYL)METHYLSULFANYL)8OXO9AZASPIRO(55)UNDEC10ENE711DICARBONITRILE
2((4BROMOBENZYL)SULFANYL)4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
2((4BROMOPHENYL)METHYLTHIO)4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
2(4BROMOBENZYLSULFANYL)4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
309278431
4((4bromophenyl)methylsulfanyl)2oxo3azaspiro(55)undec4ene15dicarbonitrile
C1CCC2(CC1)C(C(=O)NC(=C2C#N)SCC3=CC=C(C=C3)Br)C#N
InChI=1SC19H18BrN3OSc20146413(5714)12251816(1122)19(8213919)15(1021)17(24)2318h4715H138912H2(H2324)
MFCD01444517
ZINC000000850030
ZINC000000850031
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