Vitas-M small molecule compound
N-(4-bromophenyl)-2-{8-[(2,4-dimethylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Catalog ID
STL105744
SMILES Brc1ccc(cc1)NC(=O)Cn1nc2n(c1=O)ccnc2Sc1ccc(cc1C)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 C21H18BrN5O2S MW 484.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN5O2S/c1-13-3-8-17(14(2)11-13)30-20-19-25-27(21(29)26(19)10-9-23-20)12-18(28)24-16-6-4-15(22)5-7-16/h3-11H,12H2,1-2H3,(H,24,28)InChIKey
DSRXSRBPSRAVNK-UHFFFAOYSA-NSynonyms
1251617-71-61251617716
CC1=CC(=C(C=C1)SC2=NC=CN3C2=NN(C3=O)CC(=O)NC4=CC=C(C=C4)Br)C
InChI=1SC21H18BrN5O2Sc1133817(14(2)1113)3020192527(21(29)26(19)1092320)1218(28)24166415(22)5716h311H12H212H3(H2428)
MFCD20736935
N(4bromophenyl)2(8((24dimethylphenyl)sulfanyl)3oxo(124)triazolo(43a)pyrazin2(3H)yl)acetamide
N(4BROMOPHENYL)2(8((24DIMETHYLPHENYL)THIO)3OXO(124)TRIAZOLO(43A)PYRAZIN2(3H)YL)ACETAMIDE
N(4bromophenyl)2(8(24dimethylphenyl)sulfanyl3oxo(124)triazolo(43a)pyrazin2yl)acetamide
ZINC000049009057
ZINC49009057
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