Vitas-M small molecule compound

6-amino-4-{4-[(2-chloro-6-fluorobenzyl)oxy]-3-ethoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Catalog ID
STK010489
SMILES CCOc1cc(ccc1OCc1c(F)cccc1Cl)C1C(=C(N)Oc2c1c(C)n[nH]2)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 C23H20ClFN4O3 MW 454.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClFN4O3/c1-3-30-19-9-13(7-8-18(19)31-11-15-16(24)5-4-6-17(15)25)21-14(10-26)22(27)32-23-20(21)12(2)28-29-23/h4-9,21H,3,11,27H2,1-2H3,(H,28,29)
InChIKey
CVMSVUBYBLPGIC-UHFFFAOYSA-N
Synonyms
364745-08-4
364745084
6AMINO4(4((2CHLORO6FLUOROBENZYL)OXY)3ETHOXYPHENYL)3METHYL14DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(4((2CHLORO6FLUOROPHENYL)METHOXY)3ETHOXYPHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(4((2CHLORO6FLUOROPHENYL)METHOXY)3ETHOXYPHENYL)3METHYL4HPYRANO(32D)PYRAZOLE5CARBONITRILE
CCOC1=C(C=CC(=C1)C2C(=C(OC3=NNC(=C23)C)N)C#N)OCC4=C(C=CC=C4Cl)F
CCOc1cc(ccc1OCc1c(F)cccc1Cl)C1C(=C(N)Oc2c1c(C)n(nH)2)C#N
InChI=1SC23H20ClFN4O3c133019913(7818(19)31111516(24)54617(15)25)2114(1026)22(27)322320(21)12(2)282923h4921H31127H212H3(H2829)
MFCD02631337
STK010489
ZINC000001086202
ZINC000001086203

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Available files

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