Vitas-M small molecule compound
N-phenyl-2-[(5,10,10-trimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Catalog ID
STK543771
SMILES O=C(Nc1ccccc1)CSc1nnc2n1c(C)nc1c2c2CC(C)(C)OCc2s1
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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 C21H21N5O2S2 MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S2/c1-12-22-19-17(14-9-21(2,3)28-10-15(14)30-19)18-24-25-20(26(12)18)29-11-16(27)23-13-7-5-4-6-8-13/h4-8H,9-11H2,1-3H3,(H,23,27)InChIKey
SKQTZYARTHYLRE-UHFFFAOYSA-NSynonyms
489415-12-5489415125
CC1=NC2=C(C3=C(S2)COC(C3)(C)C)C4=NN=C(N14)SCC(=O)NC5=CC=CC=C5
InChI=1SC21H21N5O2S2c112221917(14921(23)281015(14)3019)18242520(26(12)18)291116(27)23137546813h48H911H213H3(H2327)
MFCD03296465
Nphenyl2((51010trimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetamide
Nphenyl2((51010trimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetamide
ZINC000001250283
ZINC01250283
ZINC1250283
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