Vitas-M small molecule compound
2-(hexylsulfanyl)-4-hydroxy-3-azaspiro[5.5]undeca-1,3-diene-1,5-dicarbonitrile
Catalog ID
STL046697
SMILES CCCCCCSC1=C(C#N)C2(C(C(=N1)O)C#N)CCCCC2
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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 C18H25N3OS MW 331.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3OS/c1-2-3-4-8-11-23-17-15(13-20)18(9-6-5-7-10-18)14(12-19)16(22)21-17/h14H,2-11H2,1H3,(H,21,22)InChIKey
VJAFVAIJWDXTEU-UHFFFAOYSA-NSynonyms
185414-63-5(5S)2(HEXYLSULFANYL)4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
10HEXYLSULFANYL8OXO9AZASPIRO(55)UNDEC10ENE711DICARBONITRILE
185414635
2(hexylsulfanyl)4hydroxy3azaspiro(55)undeca13diene15dicarbonitrile
2(HEXYLSULFANYL)4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
2HEXYLSULFANYL4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
4hexylsulfanyl2oxo3azaspiro(55)undec4ene15dicarbonitrile
CCCCCCSC1=C(C2(CCCCC2)C(C(=O)N1)C#N)C#N
InChI=1SC18H25N3OSc1234811231715(1320)18(96571018)14(1219)16(22)2117h14H211H21H3(H2122)
MFCD03796347
ZINC000004791472
ZINC000004791474
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