Vitas-M small molecule compound

2-amino-4,4-bis(ethylsulfanyl)-6-(4-fluorophenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

Catalog ID
STK781829
SMILES CCSC1(SCC)N=C(C2(C1(C#N)C2c1ccc(cc1)F)C#N)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 C17H17FN4S2 MW 360.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17FN4S2/c1-3-23-17(24-4-2)16(10-20)13(11-5-7-12(18)8-6-11)15(16,9-19)14(21)22-17/h5-8,13H,3-4H2,1-2H3,(H2,21,22)
InChIKey
JHXWOSNCSXBZOP-UHFFFAOYSA-N
Synonyms

2amino44bis(ethylsulfanyl)6(4fluorophenyl)3azabicyclo(310)hex2ene15dicarbonitrile
4AMINO22BIS(ETHYLSULFANYL)6(4FLUOROPHENYL)3AZABICYCLO(310)HEX3ENE15DICARBONITRILE
4AMINO22BIS(ETHYLTHIO)6(4FLUOROPHENYL)3AZABICYCLO(310)HEX3ENE15DICARBONITRILE
4AZANYL22BIS(ETHYLSULFANYL)6(4FLUOROPHENYL)3AZABICYCLO(310)HEX3ENE15DICARBONITRILE
CCSC1(C2(C(C2(C(=N1)N)C#N)C3=CC=C(C=C3)F)C#N)SCC
InChI=1SC17H17FN4S2c132317(2442)16(1020)13(115712(18)8611)15(16919)14(21)2217h5813H34H212H3(H22122)
MFCD04096658
ZINC000103021028
ZINC000195432534

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Available files

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