Vitas-M small molecule compound
6-amino-3-(4-methylphenyl)-4-[4-(trifluoromethyl)phenyl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK996387
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(F)(F)F)c(n[nH]2)c1ccc(cc1)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 C21H15F3N4O MW 396.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15F3N4O/c1-11-2-4-13(5-3-11)18-17-16(12-6-8-14(9-7-12)21(22,23)24)15(10-25)19(26)29-20(17)28-27-18/h2-9,16H,26H2,1H3,(H,27,28)InChIKey
GCSWUYKDOPWLAJ-UHFFFAOYSA-NSynonyms
6amino3(4methylphenyl)4(4(trifluoromethyl)phenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO3(4METHYLPHENYL)4(4(TRIFLUOROMETHYL)PHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)C(F)(F)F
InChI=1SC21H15F3N4Oc1112413(5311)181716(126814(9712)21(2223)24)15(1025)19(26)2920(17)282718h2916H26H21H3(H2728)
MFCD02764484
N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(F)(F)F)c(n(nH)2)c1ccc(cc1)C
ZINC000005490731
ZINC000005490739
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