Vitas-M small molecule compound
N-(3-chlorophenyl)-2-{8-[(2,4-dimethylphenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Catalog ID
STL105735
SMILES Cc1ccc(c(c1)C)Sc1nccn2c1nn(c2=O)CC(=O)Nc1cccc(c1)Cl
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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 C21H18ClN5O2S MW 439.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O2S/c1-13-6-7-17(14(2)10-13)30-20-19-25-27(21(29)26(19)9-8-23-20)12-18(28)24-16-5-3-4-15(22)11-16/h3-11H,12H2,1-2H3,(H,24,28)InChIKey
LSPAPEDDRRLWRQ-UHFFFAOYSA-NSynonyms
1251550-30-71251550307
CC1=CC(=C(C=C1)SC2=NC=CN3C2=NN(C3=O)CC(=O)NC4=CC(=CC=C4)Cl)C
InChI=1SC21H18ClN5O2Sc1136717(14(2)1013)3020192527(21(29)26(19)982320)1218(28)241653415(22)1116h311H12H212H3(H2428)
MFCD20736926
N(3chlorophenyl)2(8((24dimethylphenyl)sulfanyl)3oxo(124)triazolo(43a)pyrazin2(3H)yl)acetamide
N(3CHLOROPHENYL)2(8((24DIMETHYLPHENYL)THIO)3OXO(124)TRIAZOLO(43A)PYRAZIN2(3H)YL)ACETAMIDE
N(3chlorophenyl)2(8(24dimethylphenyl)sulfanyl3oxo(124)triazolo(43a)pyrazin2yl)acetamide
ZINC000049009046
ZINC49009046
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