Vitas-M small molecule compound
2-{[10,10-dimethyl-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(tetrahydrofuran-2-ylmethyl)acetamide
Catalog ID
STK943496
SMILES O=C(CSc1nnc2n1c(SC(C)C)nc1c2c2CC(C)(C)OCc2s1)NCC1CCCO1
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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 C22H29N5O3S3 MW 507.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O3S3/c1-12(2)32-20-24-19-17(14-8-22(3,4)30-10-15(14)33-19)18-25-26-21(27(18)20)31-11-16(28)23-9-13-6-5-7-29-13/h12-13H,5-11H2,1-4H3,(H,23,28)InChIKey
DMJFTLWKVRGPAF-UHFFFAOYSA-NSynonyms
849910-91-42((1010dimethyl5(propan2ylsulfanyl)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)N(tetrahydrofuran2ylmethyl)acetamide
2((5(isopropylthio)1010dimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)N((tetrahydrofuran2yl)methyl)acetamide
849910914
CC(C)SC1=NC2=C(C3=C(S2)COC(C3)(C)C)C4=NN=C(N41)SCC(=O)NCC5CCCO5
InChI=1SC22H29N5O3S3c112(2)3220241917(14822(34)301015(14)3319)18252621(27(18)20)311116(28)239136572913h1213H511H214H3(H2328)
MFCD05688466
ZINC000009500367
ZINC000009500374
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