Vitas-M small molecule compound
1-{2-(benzylsulfanyl)-7-[(E)-2-(dimethylamino)ethenyl][1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethanone
Catalog ID
STL361678
SMILES CN(/C=C/c1c(cnc2n1nc(n2)SCc1ccccc1)C(=O)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 C18H19N5OS MW 353.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5OS/c1-13(24)15-11-19-17-20-18(25-12-14-7-5-4-6-8-14)21-23(17)16(15)9-10-22(2)3/h4-11H,12H2,1-3H3/b10-9+InChIKey
QWWHSPVUSIQDMY-MDZDMXLPSA-NSynonyms
1306753-48-91(2(benzylsulfanyl)7((E)2(dimethylamino)ethenyl)(124)triazolo(15a)pyrimidin6yl)ethanone
1(2(BENZYLTHIO)7((E)2(DIMETHYLAMINO)VINYL)(124)TRIAZOLO(15A)PYRIMIDIN6YL)ETHANONE
1(2benzylsulfanyl7((E)2(dimethylamino)ethenyl)(124)triazolo(15a)pyrimidin6yl)ethanone
1306753489
CC(=O)C1=C(N2C(=NC(=N2)SCC3=CC=CC=C3)N=C1)C=CN(C)C
CN(C=Cc1c(cnc2n1nc(n2)SCc1ccccc1)C(=O)C)C
InChI=1SC18H19N5OSc113(24)151119172018(2512147546814)2123(17)16(15)91022(2)3h411H12H213H3b109+
MFCD19103622
ZINC000066324808
ZINC66324808
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