Vitas-M small molecule compound
1-[4-(3,4-dihydroisoquinolin-2(1H)-yl)-4-oxobutyl]-4-(3-methylbutyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STL135119
SMILES CC(CCn1c2nnc(n2c2c(c1=O)scc2)CCCC(=O)N1CCc2c(C1)cccc2)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 C25H29N5O2S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O2S/c1-17(2)10-14-29-24(32)23-20(12-15-33-23)30-21(26-27-25(29)30)8-5-9-22(31)28-13-11-18-6-3-4-7-19(18)16-28/h3-4,6-7,12,15,17H,5,8-11,13-14,16H2,1-2H3InChIKey
SNARNEQHOMWWCE-UHFFFAOYSA-NSynonyms
1(4(34dihydroisoquinolin2(1H)yl)4oxobutyl)4(3methylbutyl)thieno(23e)(124)triazolo(43a)pyrimidin5(4H)one
CC(C)CCN1C(=O)C2=C(C=CS2)N3C1=NN=C3CCCC(=O)N4CCC5=CC=CC=C5C4
InChI=1SC25H29N5O2Sc117(2)10142924(32)2320(12153323)3021(262725(29)30)85922(31)28131118634719(18)1628h3467121517H5811131416H212H3
MFCD20754159
ZINC000067342077
ZINC67342077
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