Vitas-M small molecule compound
N-(3-methylphenyl)-2-[(2-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
STK586447
SMILES O=C(Nc1cccc(c1)C)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)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 C22H21N7OS2 MW 463.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N7OS2/c1-12-6-5-7-14(10-12)24-17(30)11-31-22-26-25-21-28(22)20-18(19-23-13(2)27-29(19)21)15-8-3-4-9-16(15)32-20/h5-7,10H,3-4,8-9,11H2,1-2H3,(H,24,30)InChIKey
KTGPKCPIIZIPEH-UHFFFAOYSA-NSynonyms
850730-05-12((2methyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)N(mtolyl)acetamide
850730051
CC1=CC(=CC=C1)NC(=O)CSC2=NN=C3N2C4=C(C5=C(S4)CCCC5)C6=NC(=NN63)C
InChI=1SC22H21N7OS2c11265714(1012)2417(30)11312226252128(22)2018(192313(2)2729(19)21)15834916(15)3220h5710H348911H212H3(H2430)
MFCD05692911
N(3methylphenyl)2((2methyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)acetamide
ZINC000002398750
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