Vitas-M small molecule compound
1-[(2-chlorobenzyl)sulfanyl]-4-(4-chlorophenyl)-7-methyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK557157
SMILES CC1CCc2c(C1)c1c(s2)n2c(SCc3ccccc3Cl)nnc2n(c1=O)c1ccc(cc1)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 C25H20Cl2N4OS2 MW 527.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20Cl2N4OS2/c1-14-6-11-20-18(12-14)21-22(32)30(17-9-7-16(26)8-10-17)24-28-29-25(31(24)23(21)34-20)33-13-15-4-2-3-5-19(15)27/h2-5,7-10,14H,6,11-13H2,1H3InChIKey
BOPDXLLIFFWGGS-UHFFFAOYSA-NSynonyms
573971-60-51((2chlorobenzyl)sulfanyl)4(4chlorophenyl)7methyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((2chlorobenzyl)thio)4(4chlorophenyl)7methyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
573971605
CC1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC5=CC=CC=C5Cl)N(C3=O)C6=CC=C(C=C6)Cl
InChI=1SC25H20Cl2N4OS2c1146112018(1214)2122(32)30(179716(26)81017)24282925(31(24)23(21)3420)331315423519(15)27h2571014H61113H21H3
MFCD04023040
ZINC000002366430
ZINC000002366432
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