Vitas-M small molecule compound
1-[(3,4-dichlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-8-methyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK283386
SMILES COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCC(Cc1s2)C)SCc1ccc(c(c1)Cl)Cl
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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 C26H22Cl2N4O2S2 MW 557.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22Cl2N4O2S2/c1-14-3-9-18-21(11-14)36-24-22(18)23(33)31(16-5-7-17(34-2)8-6-16)25-29-30-26(32(24)25)35-13-15-4-10-19(27)20(28)12-15/h4-8,10,12,14H,3,9,11,13H2,1-2H3InChIKey
INQIVQJRUAJVJZ-UHFFFAOYSA-NSynonyms
374915-88-51((34dichlorobenzyl)sulfanyl)4(4methoxyphenyl)8methyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((34dichlorobenzyl)thio)4(4methoxyphenyl)8methyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
374915885
CC1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC(=C(C=C5)Cl)Cl)C6=CC=C(C=C6)OC
InChI=1SC26H22Cl2N4O2S2c114391821(1114)362422(18)23(33)31(165717(342)8616)25293026(32(24)25)35131541019(27)20(28)1215h48101214H391113H212H3
MFCD02235576
ZINC000001839495
ZINC000001839496
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