Vitas-M small molecule compound
6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-2-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4(3H)-one
Catalog ID
STK260248
SMILES Fc1ccc(cc1)N1CCN(CC1)c1nc(CSc2nc3c(s2)cccc3)cc(=O)[nH]1
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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 C22H20FN5OS2 MW 453.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN5OS2/c23-15-5-7-17(8-6-15)27-9-11-28(12-10-27)21-24-16(13-20(29)26-21)14-30-22-25-18-3-1-2-4-19(18)31-22/h1-8,13H,9-12,14H2,(H,24,26,29)InChIKey
LXERPVKWVOODNC-UHFFFAOYSA-NSynonyms
6((13benzothiazol2ylsulfanyl)methyl)2(4(4fluorophenyl)piperazin1yl)pyrimidin4(3H)one
6(13benzothiazol2ylsulfanylmethyl)2(4(4fluorophenyl)piperazin1yl)1Hpyrimidin4one
6(BENZOTHIAZOL2YLTHIOMETHYL)2(4(4FLUOROPHENYL)PIPERAZINYL)3HYDROPYRIMIDIN4ONE
C1CN(CCN1C2=CC=C(C=C2)F)C3=NC(=O)C=C(N3)CSC4=NC5=CC=CC=C5S4
Fc1ccc(cc1)N1CCN(CC1)c1nc(CSc2nc3c(s2)cccc3)cc(=O)(nH)1
InChI=1SC22H20FN5OS2c23155717(8615)2791128(121027)212416(1320(29)2621)1430222518312419(18)3122h1813H91214H2(H242629)
MFCD08575852
ZINC000009426370
ZINC09426370
ZINC9426370
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