Vitas-M small molecule compound
[4-(2-methoxyphenyl)piperazin-1-yl](1',3',5'-trimethyl-1'H,2H-3,4'-bipyrazol-5-yl)methanone
Catalog ID
STL319579
SMILES COc1ccccc1N1CCN(CC1)C(=O)c1n[nH]c(c1)c1c(C)nn(c1C)C
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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 C21H26N6O2 MW 394.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O2/c1-14-20(15(2)25(3)24-14)16-13-17(23-22-16)21(28)27-11-9-26(10-12-27)18-7-5-6-8-19(18)29-4/h5-8,13H,9-12H2,1-4H3,(H,22,23)InChIKey
LMNIQPCBWKXBRR-UHFFFAOYSA-NSynonyms
1491129-36-2(4(2methoxyphenyl)piperazin1yl)(135trimethyl1H1H(34bipyrazol)5yl)methanone
(4(2methoxyphenyl)piperazin1yl)(135trimethyl1H2H34bipyrazol5yl)methanone
(4(2methoxyphenyl)piperazin1yl)(3(135trimethylpyrazol4yl)1Hpyrazol5yl)methanone
1491129362
CC1=C(C(=NN1C)C)C2=NNC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4OC
COc1ccccc1N1CCN(CC1)C(=O)c1(nH)nc(c1)c1c(C)nn(c1C)C
COc1ccccc1N1CCN(CC1)C(=O)c1n(nH)c(c1)c1c(C)nn(c1C)C
InChI=1SC21H26N6O2c11420(15(2)25(3)2414)161317(232216)21(28)2711926(101227)18756819(18)294h5813H912H214H3(H2223)
MFCD27962405
ZINC000095480176
ZINC95480176
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