Vitas-M small molecule compound
4-amino-4'-methyl-6-[4-(methylsulfanyl)phenyl]spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
Catalog ID
STK711772
SMILES CSc1ccc(cc1)C1C2(C1(C#N)C(=NC12OCC(O1)C)N)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 C17H16N4O2S MW 340.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O2S/c1-10-7-22-17(23-10)16(9-19)13(15(16,8-18)14(20)21-17)11-3-5-12(24-2)6-4-11/h3-6,10,13H,7H2,1-2H3,(H2,20,21)InChIKey
ZZJGVOXXUJAQLL-UHFFFAOYSA-NSynonyms
2AMINO4METHYL6(4METHYLSULFANYLPHENYL)SPIRO(13DIOXOLANE243AZABICYCLO(310)HEX2ENE)15DICARBONITRILE
4amino4methyl6(4(methylsulfanyl)phenyl)spiro(3azabicyclo(310)hex3ene22(13)dioxolane)15dicarbonitrile
4amino4methyl6(4methylsulfanylphenyl)spiro(13dioxolane223azabicyclo(310)hex3ene)15dicarbonitrile
CC1COC2(O1)C3(C(C3(C(=N2)N)C#N)C4=CC=C(C=C4)SC)C#N
InChI=1SC17H16N4O2Sc11072217(2310)16(919)13(15(16818)14(20)2117)113512(242)6411h361013H7H212H3(H22021)
MFCD04096882
ZINC000036044182
ZINC000247987661
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