Vitas-M small molecule compound
N-(3-methylphenyl)-2-[(12-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]acetamide
Catalog ID
STK720692
SMILES CC1CCc2c(C1)c1c(s2)n2c(SCC(=O)Nc3cccc(c3)C)nnc2n2c1ncn2
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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 C22H21N7OS2 MW 463.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N7OS2/c1-12-4-3-5-14(8-12)25-17(30)10-31-22-27-26-21-28(22)20-18(19-23-11-24-29(19)21)15-9-13(2)6-7-16(15)32-20/h3-5,8,11,13H,6-7,9-10H2,1-2H3,(H,25,30)InChIKey
AFQDSJRUOSUSRE-UHFFFAOYSA-NSynonyms
877801-28-02((12methyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)N(mtolyl)acetamide
877801280
CC1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC(=O)NC5=CC=CC(=C5)C)N6C3=NC=N6
InChI=1SC22H21N7OS2c11243514(812)2517(30)10312227262128(22)2018(1923112429(19)21)15913(2)6716(15)3220h3581113H67910H212H3(H2530)
MFCD05704093
N(3methylphenyl)2((12methyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)acetamide
ZINC000009345978
ZINC000009345980
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