Vitas-M small molecule compound
2-[{[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetyl}(methyl)amino]ethyl [(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetate
Catalog ID
STK687769
SMILES O=C(CSc1nn2c(n1)nc(cc2C)C)OCCN(C(=O)CSc1nn2c(n1)nc(cc2C)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 C21H25N9O3S2 MW 515.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N9O3S2/c1-12-8-14(3)29-18(22-12)24-20(26-29)34-10-16(31)28(5)6-7-33-17(32)11-35-21-25-19-23-13(2)9-15(4)30(19)27-21/h8-9H,6-7,10-11H2,1-5H3InChIKey
AUAFXHOOBNMPQG-UHFFFAOYSA-NSynonyms
2((((57dimethyl(124)triazolo(15a)pyrimidin2yl)sulfanyl)acetyl)(methyl)amino)ethyl((57dimethyl(124)triazolo(15a)pyrimidin2yl)sulfanyl)acetate
2((2((57DIMETHYL(124)TRIAZOLO(15A)PYRIMIDIN2YL)SULFANYL)ACETYL)METHYLAMINO)ETHYL2((57DIMETHYL(124)TRIAZOLO(15A)PYRIMIDIN2YL)SULFANYL)ACETATE
CC1=CC(=NC2=NC(=NN12)SCC(=O)N(C)CCOC(=O)CSC3=NN4C(=CC(=NC4=N3)C)C)C
InChI=1SC21H25N9O3S2c112814(3)2918(2212)2420(2629)341016(31)28(5)673317(32)11352125192313(2)915(4)30(19)2721h89H671011H215H3
MFCD07021703
ZINC000012446131
ZINC12446131
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