Vitas-M small molecule compound
6-amino-8-(3-fluorophenyl)-8,8a-dihydro-1H-isothiochromene-5,7,7(3H)-tricarbonitrile
Catalog ID
STK730538
SMILES N#CC1=C(N)C(C(C2C1=CCSC2)c1cccc(c1)F)(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 C18H13FN4S MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13FN4S/c19-12-3-1-2-11(6-12)16-15-8-24-5-4-13(15)14(7-20)17(23)18(16,9-21)10-22/h1-4,6,15-16H,5,8,23H2InChIKey
JWUYAWQXVCDGMQ-UHFFFAOYSA-NSynonyms
6amino8(3fluorophenyl)1388atetrahydroisothiochromene577tricarbonitrile
6amino8(3fluorophenyl)88adihydro1Hisothiochromene577(3H)tricarbonitrile
C1C=C2C(CS1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC(=CC=C3)F
InChI=1SC18H13FN4Sc191231211(612)16158245413(15)14(720)17(23)18(16921)1022h1461516H5823H2
MFCD01451444
ZINC000019874989
ZINC000020598179
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