Vitas-M small molecule compound
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:1',5'-c]pyrimidin-7-yl)sulfanyl]-1-phenylethanone
Catalog ID
STK597829
SMILES O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c1n2ncn1)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 C21H18N6O2S2 MW 450.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N6O2S2/c1-21(2)8-13-15(9-29-21)31-18-16(13)17-22-11-23-27(17)19-24-25-20(26(18)19)30-10-14(28)12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3InChIKey
YQZTYYYKYSWVDA-UHFFFAOYSA-NSynonyms
877797-78-92((1212dimethyl1213dihydro10Hpyrano(4345)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)1phenylethanone
2((1212dimethyl1213dihydro10Hpyrano(4345)thieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)1phenylethanone
877797789
CC1(CC2=C(CO1)SC3=C2C4=NC=NN4C5=NN=C(N35)SCC(=O)C6=CC=CC=C6)C
InChI=1SC21H18N6O2S2c121(2)81315(92921)311816(13)1722112327(17)19242520(26(18)19)301014(28)126435712h3711H810H212H3
MFCD05703404
ZINC000009345756
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