Vitas-M small molecule compound
2-{8-[(4-chlorobenzyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-cyclohexyl-N-methylacetamide
Catalog ID
STL098183
SMILES CN(C(=O)Cn1nc2n(c1=O)ccnc2SCc1ccc(cc1)Cl)C1CCCCC1
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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 C21H24ClN5O2S MW 445.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN5O2S/c1-25(17-5-3-2-4-6-17)18(28)13-27-21(29)26-12-11-23-20(19(26)24-27)30-14-15-7-9-16(22)10-8-15/h7-12,17H,2-6,13-14H2,1H3InChIKey
ZHNNGHDSGDTNPW-UHFFFAOYSA-NSynonyms
2(8((4chlorobenzyl)sulfanyl)3oxo(124)triazolo(43a)pyrazin2(3H)yl)NcyclohexylNmethylacetamide
2(8((4chlorophenyl)methylsulfanyl)3oxo(124)triazolo(43a)pyrazin2yl)NcyclohexylNmethylacetamide
CN(C1CCCCC1)C(=O)CN2C(=O)N3C=CN=C(C3=N2)SCC4=CC=C(C=C4)Cl
InChI=1SC21H24ClN5O2Sc125(175324617)18(28)132721(29)2612112320(19(26)2427)3014157916(22)10815h71217H261314H21H3
MFCD18789430
ZINC000067255382
ZINC67255382
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