Vitas-M small molecule compound
2-methylpropyl 4-({5-[6-amino-3-(biphenyl-4-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxybenzyl}oxy)benzoate
Catalog ID
STK496850
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)COc1ccc(cc1)C(=O)OCC(C)C)OC)c(n[nH]2)c1ccc(cc1)c1ccccc1
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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 C38H34N4O5 MW 626.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H34N4O5/c1-23(2)21-46-38(43)27-13-16-30(17-14-27)45-22-29-19-28(15-18-32(29)44-3)33-31(20-39)36(40)47-37-34(33)35(41-42-37)26-11-9-25(10-12-26)24-7-5-4-6-8-24/h4-19,23,33H,21-22,40H2,1-3H3,(H,41,42)InChIKey
MOQKFBHDPUPLTL-UHFFFAOYSA-NSynonyms
667404-78-62methylpropyl4((5(6amino3(biphenyl4yl)5cyano14dihydropyrano(23c)pyrazol4yl)2methoxybenzyl)oxy)benzoate
2METHYLPROPYL4((5(6AMINO5CYANO3(4PHENYLPHENYL)24DIHYDROPYRANO(23C)PYRAZOL4YL)2METHOXYPHENYL)METHOXY)BENZOATE
667404786
CC(C)COC(=O)C1=CC=C(C=C1)OCC2=C(C=CC(=C2)C3C(=C(OC4=NNC(=C34)C5=CC=C(C=C5)C6=CC=CC=C6)N)C#N)OC
InChI=1SC38H34N4O5c123(2)214638(43)27131630(171427)4522291928(151832(29)443)3331(2039)36(40)473734(33)35(414237)2611925(101226)247546824h4192333H212240H213H3(H4142)
ISOBUTYL4((5(6AMINO3(11BIPHENYL)4YL5CYANO14DIHYDROPYRANO(23C)PYRAZOL4YL)2METHOXYBENZYL)OXY)BENZOATE
MFCD03341679
N#CC1=C(N)Oc2c(C1c1ccc(c(c1)COc1ccc(cc1)C(=O)OCC(C)C)OC)c(n(nH)2)c1ccc(cc1)c1ccccc1
ZINC000008437650
ZINC000008437652
Check stock
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Check stock on Vitas-MAvailable files
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