Vitas-M small molecule compound
2-{8-[(4-chlorobenzyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[4-(propan-2-yl)phenyl]acetamide
Catalog ID
STL105664
SMILES O=C(Cn1nc2n(c1=O)ccnc2SCc1ccc(cc1)Cl)Nc1ccc(cc1)C(C)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 C23H22ClN5O2S MW 467.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN5O2S/c1-15(2)17-5-9-19(10-6-17)26-20(30)13-29-23(31)28-12-11-25-22(21(28)27-29)32-14-16-3-7-18(24)8-4-16/h3-12,15H,13-14H2,1-2H3,(H,26,30)InChIKey
RSTAYLHYWBVTDC-UHFFFAOYSA-NSynonyms
2(8((4chlorobenzyl)sulfanyl)3oxo(124)triazolo(43a)pyrazin2(3H)yl)N(4(propan2yl)phenyl)acetamide
2(8((4chlorophenyl)methylsulfanyl)3oxo(124)triazolo(43a)pyrazin2yl)N(4propan2ylphenyl)acetamide
CC(C)C1=CC=C(C=C1)NC(=O)CN2C(=O)N3C=CN=C(C3=N2)SCC4=CC=C(C=C4)Cl
InChI=1SC23H22ClN5O2Sc115(2)175919(10617)2620(30)132923(31)2812112522(21(28)2729)3214163718(24)8416h31215H1314H212H3(H2630)
MFCD20736855
ZINC000067255364
ZINC67255364
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