Vitas-M small molecule compound
[4-(4-chlorophenyl)piperazin-1-yl][5-(3-methoxyphenyl)-1H-pyrazol-3-yl]methanone
Catalog ID
STL027270
SMILES COc1cccc(c1)c1[nH]nc(c1)C(=O)N1CCN(CC1)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 C21H21ClN4O2 MW 396.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O2/c1-28-18-4-2-3-15(13-18)19-14-20(24-23-19)21(27)26-11-9-25(10-12-26)17-7-5-16(22)6-8-17/h2-8,13-14H,9-12H2,1H3,(H,23,24)InChIKey
FBYMVEIUIDDMHO-UHFFFAOYSA-NSynonyms
(4(4chlorophenyl)piperazin1yl)(3(3methoxyphenyl)1Hpyrazol5yl)methanone
(4(4chlorophenyl)piperazin1yl)(5(3methoxyphenyl)1Hpyrazol3yl)methanone
COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)Cl
COc1cccc(c1)c1(nH)nc(c1)C(=O)N1CCN(CC1)c1ccc(cc1)Cl
InChI=1SC21H21ClN4O2c1281842315(1318)191420(242319)21(27)2611925(101226)177516(22)6817h281314H912H21H3(H2324)
MFCD18187924
ZINC000015679310
ZINC15679310
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