Vitas-M small molecule compound
N-(4-bromophenyl)-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
STK721051
SMILES O=C(Nc1ccc(cc1)Br)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 C21H20BrN5O2S2 MW 518.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN5O2S2/c1-11-23-19-17(14-8-21(2,3)29-9-15(14)31-19)18-25-26-20(27(11)18)30-10-16(28)24-13-6-4-12(22)5-7-13/h4-7H,8-10H2,1-3H3,(H,24,28)InChIKey
BBWGMCYFZXRXCJ-UHFFFAOYSA-NSynonyms
487031-05-0487031050
CC1=NC2=C(C3=C(S2)COC(C3)(C)C)C4=NN=C(N14)SCC(=O)NC5=CC=C(C=C5)Br
InChI=1SC21H20BrN5O2S2c111231917(14821(23)29915(14)3119)18252620(27(11)18)301016(28)24136412(22)5713h47H810H213H3(H2428)
MFCD03286893
N(4bromophenyl)2((51010trimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetamide
N(4bromophenyl)2((51010trimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetamide
ZINC000001242915
ZINC01242915
ZINC1242915
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