Vitas-M small molecule compound

6-amino-4-(3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Catalog ID
STK084066
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)CN1CCN(CC1)c1ccc(cc1)F)OC)c(C)n[nH]2

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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 C26H27FN6O2 MW 474.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27FN6O2/c1-16-23-24(21(14-28)25(29)35-26(23)31-30-16)17-3-8-22(34-2)18(13-17)15-32-9-11-33(12-10-32)20-6-4-19(27)5-7-20/h3-8,13,24H,9-12,15,29H2,1-2H3,(H,30,31)
InChIKey
RMRMZYPGKLMUFK-UHFFFAOYSA-N
Synonyms
421573-69-5
421573695
6AMINO4(3((4(4FLUOROPHENYL)PIPERAZIN1YL)METHYL)4METHOXYPHENYL)3METHYL14DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(3((4(4FLUOROPHENYL)PIPERAZIN1YL)METHYL)4METHOXYPHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(3((4(4FLUOROPHENYL)PIPERAZINYL)METHYL)4METHOXYPHENYL)3METHYL4HPYRANO(32D)PYRAZOLE5CARBONITRILE
CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C=C3)OC)CN4CCN(CC4)C5=CC=C(C=C5)F
InChI=1SC26H27FN6O2c1162324(21(1428)25(29)3526(23)313016)173822(342)18(1317)153291133(121032)206419(27)5720h381324H9121529H212H3(H3031)
MFCD02631368
N#CC1=C(N)Oc2c(C1c1ccc(c(c1)CN1CCN(CC1)c1ccc(cc1)F)OC)c(C)n(nH)2
STK084066
ZINC000009009589
ZINC000009009590

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Available files

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