Vitas-M small molecule compound
pentyl [(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]acetate
Catalog ID
STK599527
SMILES CCCCCOC(=O)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 C20H24N6O3S2 MW 460.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N6O3S2/c1-4-5-6-7-28-14(27)10-30-19-24-23-18-25(19)17-15(16-21-11-22-26(16)18)12-8-20(2,3)29-9-13(12)31-17/h11H,4-10H2,1-3H3InChIKey
LDGMKSJIZRNQJT-UHFFFAOYSA-NSynonyms
850735-81-8850735818
CCCCCOC(=O)CSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)(C)C)C5=NC=NN52
InChI=1SC20H24N6O3S2c145672814(27)10301924231825(19)1715(1621112226(16)18)12820(23)29913(12)3117h11H410H213H3
MFCD05693219
pentyl((1212dimethyl1213dihydro10Hpyrano(4345)thieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)acetate
pentyl2((1212dimethyl1213dihydro10Hpyrano(4345)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)acetate
ZINC000002402402
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