Vitas-M small molecule compound
1-(4-{[(8-chloro-6-methyl-5,5-dioxido-6H-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]methyl}phenyl)pyrrolidin-2-one
Catalog ID
STL125948
SMILES Clc1ccc2c(c1)N(C)S(=O)(=O)c1c2nc(SCc2ccc(cc2)N2CCCC2=O)nc1
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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 C22H19ClN4O3S2 MW 487.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O3S2/c1-26-18-11-15(23)6-9-17(18)21-19(32(26,29)30)12-24-22(25-21)31-13-14-4-7-16(8-5-14)27-10-2-3-20(27)28/h4-9,11-12H,2-3,10,13H2,1H3InChIKey
FTFGCCJPXVUSIX-UHFFFAOYSA-NSynonyms
1(4(((8chloro6methyl55dioxido6Hpyrimido(54c)(21)benzothiazin2yl)sulfanyl)methyl)phenyl)pyrrolidin2one
1(4((8chloro6methyl55dioxopyrimido(54c)(21)benzothiazin2yl)sulfanylmethyl)phenyl)pyrrolidin2one
CN1C2=C(C=CC(=C2)Cl)C3=NC(=NC=C3S1(=O)=O)SCC4=CC=C(C=C4)N5CCCC5=O
InChI=1SC22H19ClN4O3S2c126181115(23)6917(18)2119(32(2629)30)122422(2521)3113144716(8514)27102320(27)28h491112H231013H21H3
MFCD20738374
ZINC000067260207
ZINC67260207
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