Vitas-M small molecule compound
1-(4-benzylpiperazin-1-yl)-2-{[2-(4-ethoxyphenyl)pyrazolo[1,5-a]pyrazin-4-yl]sulfanyl}ethanone
Catalog ID
STL128809
SMILES CCOc1ccc(cc1)c1nn2c(c1)c(ncc2)SCC(=O)N1CCN(CC1)Cc1ccccc1
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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 C27H29N5O2S MW 487.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2S/c1-2-34-23-10-8-22(9-11-23)24-18-25-27(28-12-13-32(25)29-24)35-20-26(33)31-16-14-30(15-17-31)19-21-6-4-3-5-7-21/h3-13,18H,2,14-17,19-20H2,1H3InChIKey
KOALXVKBNGRTDY-UHFFFAOYSA-NSynonyms
1(4benzylpiperazin1yl)2((2(4ethoxyphenyl)pyrazolo(15a)pyrazin4yl)sulfanyl)ethanone
1(4benzylpiperazin1yl)2(2(4ethoxyphenyl)pyrazolo(15a)pyrazin4yl)sulfanylethanone
CCOC1=CC=C(C=C1)C2=NN3C=CN=C(C3=C2)SCC(=O)N4CCN(CC4)CC5=CC=CC=C5
InChI=1SC27H29N5O2Sc12342310822(91123)24182527(28121332(25)2924)352026(33)31161430(151731)19216435721h31318H214171920H21H3
MFCD20742643
ZINC000067290511
ZINC67290511
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