Vitas-M small molecule compound
N-(3-methylphenyl)-2-(10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-ylsulfanyl)acetamide
Catalog ID
STK582294
SMILES O=C(Nc1cccc(c1)C)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3
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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 C21H19N7OS2 MW 449.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N7OS2/c1-12-5-4-6-13(9-12)24-16(29)10-30-21-26-25-20-27(21)19-17(18-22-11-23-28(18)20)14-7-2-3-8-15(14)31-19/h4-6,9,11H,2-3,7-8,10H2,1H3,(H,24,29)InChIKey
ZZUHATKXRVWGAX-UHFFFAOYSA-NSynonyms
849913-86-62((10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)N(mtolyl)acetamide
849913866
CC1=CC(=CC=C1)NC(=O)CSC2=NN=C3N2C4=C(C5=C(S4)CCCC5)C6=NC=NN63
InChI=1SC21H19N7OS2c11254613(912)2416(29)10302126252027(21)1917(1822112328(18)20)14723815(14)3119h46911H237810H21H3(H2429)
MFCD05688784
N(3methylphenyl)2(10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidin7ylsulfanyl)acetamide
ZINC000002194226
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