Vitas-M small molecule compound
N-(2-methylphenyl)-2-{[11-(2-methylpropyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl]sulfanyl}acetamide
Catalog ID
STK721406
SMILES CC(Cc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCC(=O)Nc1ccccc1C)C
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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 C27H28N6OS2 MW 516.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N6OS2/c1-15(2)12-20-17-9-5-6-10-18(17)22-23-24(36-26(22)30-20)25-31-32-27(33(25)14-28-23)35-13-21(34)29-19-11-7-4-8-16(19)3/h4,7-8,11,14-15H,5-6,9-10,12-13H2,1-3H3,(H,29,34)InChIKey
OHIJKAJCBPDAOX-UHFFFAOYSA-NSynonyms
371120-33-12((11isobutyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinolin3yl)thio)N(otolyl)acetamide
371120331
CC1=CC=CC=C1NC(=O)CSC2=NN=C3N2C=NC4=C3SC5=NC(=C6CCCCC6=C45)CC(C)C
InChI=1SC27H28N6OS2c115(2)1220179561018(17)222324(3626(22)3020)25313227(33(25)142823)351321(34)29191174816(19)3h478111415H569101213H213H3(H2934)
MFCD03007805
N(2methylphenyl)2((11(2methylpropyl)78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinolin3yl)sulfanyl)acetamide
ZINC000009237286
ZINC09237286
ZINC9237286
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