Vitas-M small molecule compound
6-amino-3-(4-chlorophenyl)-4-{3-[(2-methylbenzyl)oxy]phenyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK496844
SMILES N#CC1=C(N)Oc2c(C1c1cccc(c1)OCc1ccccc1C)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/c1-16-5-2-3-6-19(16)15-33-21-8-4-7-18(13-21)23-22(14-29)26(30)34-27-24(23)25(31-32-27)17-9-11-20(28)12-10-17/h2-13,23H,15,30H2,1H3,(H,31,32)InChIKey
PWYKLJOZEBTIQS-UHFFFAOYSA-NSynonyms
897111-45-46amino3(4chlorophenyl)4(3((2methylbenzyl)oxy)phenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6amino3(4chlorophenyl)4(3((2methylphenyl)methoxy)phenyl)24dihydropyrano(23c)pyrazole5carbonitrile
897111454
CC1=CC=CC=C1COC2=CC=CC(=C2)C3C(=C(OC4=NNC(=C34)C5=CC=C(C=C5)Cl)N)C#N
InChI=1SC27H21ClN4O2c116523619(16)15332184718(1321)2322(1429)26(30)342724(23)25(313227)1791120(28)121017h21323H1530H21H3(H3132)
MFCD03342612
N#CC1=C(N)Oc2c(C1c1cccc(c1)OCc1ccccc1C)c(n(nH)2)c1ccc(cc1)Cl
ZINC000020418647
ZINC000020418648
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