Vitas-M small molecule compound
2-{8-[(4-chlorobenzyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-(2,5-dimethoxyphenyl)acetamide
Catalog ID
STL105661
SMILES COc1ccc(cc1NC(=O)Cn1nc2n(c1=O)ccnc2SCc1ccc(cc1)Cl)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 C22H20ClN5O4S MW 485.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5O4S/c1-31-16-7-8-18(32-2)17(11-16)25-19(29)12-28-22(30)27-10-9-24-21(20(27)26-28)33-13-14-3-5-15(23)6-4-14/h3-11H,12-13H2,1-2H3,(H,25,29)InChIKey
RABXXHCLXDRQBU-UHFFFAOYSA-NSynonyms
1251601-81-61251601816
2(8((4chlorobenzyl)sulfanyl)3oxo(124)triazolo(43a)pyrazin2(3H)yl)N(25dimethoxyphenyl)acetamide
2(8((4CHLOROBENZYL)THIO)3OXO(124)TRIAZOLO(43A)PYRAZIN2(3H)YL)N(25DIMETHOXYPHENYL)ACETAMIDE
2(8((4chlorophenyl)methylsulfanyl)3oxo(124)triazolo(43a)pyrazin2yl)N(25dimethoxyphenyl)acetamide
COC1=CC(=C(C=C1)OC)NC(=O)CN2C(=O)N3C=CN=C(C3=N2)SCC4=CC=C(C=C4)Cl
InChI=1SC22H20ClN5O4Sc131167818(322)17(1116)2519(29)122822(30)271092421(20(27)2628)3313143515(23)6414h311H1213H212H3(H2529)
MFCD20736852
ZINC000049008870
ZINC49008870
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