Vitas-M small molecule compound
2-[2-(benzylsulfanyl)-5-oxo-5,6-dihydro-4H-imidazo[1,2-b][1,2,4]triazol-6-yl]-N-(2,5-dimethoxyphenyl)acetamide
Catalog ID
STL009553
SMILES COc1ccc(c(c1)NC(=O)CC1C(=O)Nc2n1nc(n2)SCc1ccccc1)OC
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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 C21H21N5O4S MW 439.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O4S/c1-29-14-8-9-17(30-2)15(10-14)22-18(27)11-16-19(28)23-20-24-21(25-26(16)20)31-12-13-6-4-3-5-7-13/h3-10,16H,11-12H2,1-2H3,(H,22,27)(H,23,24,25,28)InChIKey
GVWMEJGAHUTKOE-UHFFFAOYSA-NSynonyms
1170654-10-01170654100
2(2(benzylsulfanyl)5oxo56dihydro4Himidazo(12b)(124)triazol6yl)N(25dimethoxyphenyl)acetamide
2(2(benzylthio)5oxo56dihydro4Himidazo(12b)(124)triazol6yl)N(25dimethoxyphenyl)acetamide
2(2benzylsulfanyl5oxo16dihydroimidazo(12b)(124)triazol6yl)N(25dimethoxyphenyl)acetamide
COC1=CC(=C(C=C1)OC)NC(=O)CC2C(=O)N=C3N2NC(=N3)SCC4=CC=CC=C4
InChI=1SC21H21N5O4Sc129148917(302)15(1014)2218(27)111619(28)23202421(2526(16)20)3112136435713h31016H1112H212H3(H2227)(H23242528)
MFCD09850687
ZINC000013688335
ZINC000013688338
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