Vitas-M small molecule compound
6-amino-3-(4-butoxyphenyl)-4-{4-[(2-fluorobenzyl)oxy]phenyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK765315
SMILES CCCCOc1ccc(cc1)c1n[nH]c2c1C(c1ccc(cc1)OCc1ccccc1F)C(=C(O2)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 C30H27FN4O3 MW 510.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27FN4O3/c1-2-3-16-36-22-14-10-20(11-15-22)28-27-26(24(17-32)29(33)38-30(27)35-34-28)19-8-12-23(13-9-19)37-18-21-6-4-5-7-25(21)31/h4-15,26H,2-3,16,18,33H2,1H3,(H,34,35)InChIKey
KQKUGNXCKDWUOG-UHFFFAOYSA-NSynonyms
6amino3(4butoxyphenyl)4(4((2fluorobenzyl)oxy)phenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO3(4BUTOXYPHENYL)4(4((2FLUOROPHENYL)METHOXY)PHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CCCCOC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5F
CCCCOc1ccc(cc1)c1n(nH)c2c1C(c1ccc(cc1)OCc1ccccc1F)C(=C(O2)N)C#N
InChI=1SC30H27FN4O3c123163622141020(111522)282726(24(1732)29(33)3830(27)353428)1981223(13919)371821645725(21)31h41526H23161833H21H3(H3435)
MFCD03035565
ZINC000008854902
ZINC000008854903
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