Vitas-M small molecule compound
4-methylmorpholin-4-ium 1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-ene-2-thiolate
Catalog ID
STK725735
SMILES C[NH+]1CCOCC1.N#CC1C(=O)NC(=C(C21CCCCC2)C#N)[S-]
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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 C17H24N4O2S MW 348.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3OS.C5H11NO/c13-6-8-10(16)15-11(17)9(7-14)12(8)4-2-1-3-5-12;1-6-2-4-7-5-3-6/h8,17H,1-5H2,(H,15,16);2-5H2,1H3InChIKey
YTMJYRQMWTZVBG-UHFFFAOYSA-NSynonyms
185414-45-3185414453
4methylmorpholin4ium15dicyano4oxo3azaspiro(55)undec1ene2thiolate
4methylmorpholine2oxo4sulfanyl3azaspiro(55)undec4ene15dicarbonitrile
4METHYLMORPHOLINE8OXO10SULFANYL9AZASPIRO(55)UNDEC10ENE711DICARBONITRILE
C(NH+)1CCOCC1N#CC1C(=O)NC(=C(C21CCCCC2)C#N)(S)
CN1CCOCC1C1CCC2(CC1)C(C(=O)NC(=C2C#N)S)C#N
InChI=1SC12H13N3OSC5H11NOc136810(16)1511(17)9(714)12(8)421351216247536h817H15H2(H1516)25H21H3
MFCD00559053
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