Vitas-M small molecule compound
2-amino-4-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK699589
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)CSc1ccccn1)OC)C(=O)CC(C2)(C)C
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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 C25H25N3O3S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3S/c1-25(2)11-18(29)23-20(12-25)31-24(27)17(13-26)22(23)15-7-8-19(30-3)16(10-15)14-32-21-6-4-5-9-28-21/h4-10,22H,11-12,14,27H2,1-3H3InChIKey
ZYBMZODAEOXDIY-UHFFFAOYSA-NSynonyms
340807-99-02amino4(4methoxy3((pyridin2ylsulfanyl)methyl)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(4methoxy3((pyridin2ylthio)methyl)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(4METHOXY3(PYRIDIN2YLSULFANYLMETHYL)PHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
340807990
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OC)CSC4=CC=CC=N4)C(=O)C1)C
InChI=1SC25H25N3O3Sc125(2)1118(29)2320(1225)3124(27)17(1326)22(23)157819(303)16(1015)14322164592821h41022H11121427H213H3
MFCD01417387
ZINC000000996358
ZINC000002740261
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