Vitas-M small molecule compound
6-amino-3-(4-chlorophenyl)-4-{4-[(4-methylbenzyl)oxy]phenyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK496848
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccc(cc1)C)c(n[nH]2)c1ccc(cc1)Cl
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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 C27H21ClN4O2 MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClN4O2/c1-16-2-4-17(5-3-16)15-33-21-12-8-18(9-13-21)23-22(14-29)26(30)34-27-24(23)25(31-32-27)19-6-10-20(28)11-7-19/h2-13,23H,15,30H2,1H3,(H,31,32)InChIKey
MJQGEDYJFHPCIB-UHFFFAOYSA-NSynonyms
897111-51-26amino3(4chlorophenyl)4(4((4methylbenzyl)oxy)phenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6amino3(4chlorophenyl)4(4((4methylphenyl)methoxy)phenyl)24dihydropyrano(23c)pyrazole5carbonitrile
897111512
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C3C(=C(OC4=NNC(=C34)C5=CC=C(C=C5)Cl)N)C#N
InChI=1SC27H21ClN4O2c1162417(5316)15332112818(91321)2322(1429)26(30)342724(23)25(313227)1961020(28)11719h21323H1530H21H3(H3132)
MFCD03342478
N#CC1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccc(cc1)C)c(n(nH)2)c1ccc(cc1)Cl
ZINC000020367361
ZINC000020367363
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