Vitas-M small molecule compound
6-amino-4-[3-(benzyloxy)phenyl]-3-(4-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK496837
SMILES N#CC1=C(N)Oc2c(C1c1cccc(c1)OCc1ccccc1)c(n[nH]2)c1ccc(cc1)OC
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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 C27H22N4O3 MW 450.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O3/c1-32-20-12-10-18(11-13-20)25-24-23(22(15-28)26(29)34-27(24)31-30-25)19-8-5-9-21(14-19)33-16-17-6-3-2-4-7-17/h2-14,23H,16,29H2,1H3,(H,30,31)InChIKey
OEFHAMOXLSPAOQ-UHFFFAOYSA-NSynonyms
667403-25-0667403250
6AMINO3(4METHOXYPHENYL)4(3PHENYLMETHOXYPHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6amino4(3(benzyloxy)phenyl)3(4methoxyphenyl)14dihydropyrano(23c)pyrazole5carbonitrile
COC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=CC=C4)OCC5=CC=CC=C5
InChI=1SC27H22N4O3c13220121018(111320)252423(22(1528)26(29)3427(24)313025)1985921(1419)3316176324717h21423H1629H21H3(H3031)
MFCD03172593
N#CC1=C(N)Oc2c(C1c1cccc(c1)OCc1ccccc1)c(n(nH)2)c1ccc(cc1)OC
ZINC000008567397
ZINC000008567401
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