Vitas-M small molecule compound
2,2'-[(12,12-dimethyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-diyl)disulfanediyl]bis[1-(4-chlorophenyl)ethanone]
Catalog ID
STK698925
SMILES Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)c2ccc(cc2)Cl)nn1)CC(OC3)(C)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 C29H22Cl2N6O3S3 MW 669.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22Cl2N6O3S3/c1-29(2)11-19-22(12-40-29)43-25-23(19)24-32-34-27(41-13-20(38)15-3-7-17(30)8-4-15)36(24)26-33-35-28(37(25)26)42-14-21(39)16-5-9-18(31)10-6-16/h3-10H,11-14H2,1-2H3InChIKey
XVWFXYHWNWOGAB-UHFFFAOYSA-NSynonyms
22((1212dimethyl1213dihydro10Hpyrano(4345)thieno(32e)bis((124)triazolo)(43a43c)pyrimidine37diyl)bis(sulfanediyl))bis(1(4chlorophenyl)ethanone)
22((1212dimethyl1213dihydro10Hpyrano(4345)thieno(32e)bis(124)triazolo(43a43c)pyrimidine37diyl)disulfanediyl)bis(1(4chlorophenyl)ethanone)
CC1(CC2=C(CO1)SC3=C2C4=NN=C(N4C5=NN=C(N35)SCC(=O)C6=CC=C(C=C6)Cl)SCC(=O)C7=CC=C(C=C7)Cl)C
InChI=1SC29H22Cl2N6O3S3c129(2)111922(124029)432523(19)24323427(411320(38)153717(30)8415)36(24)26333528(37(25)26)421421(39)165918(31)10616h310H1114H212H3
MFCD01806788
ZINC000150467808
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