Vitas-M small molecule compound
2-(4H-1,2,4-triazol-3-ylsulfanyl)-1-(2,2,4-trimethylquinolin-1(2H)-yl)ethanone
Catalog ID
STK057227
SMILES O=C(N1c2ccccc2C(=CC1(C)C)C)CSc1nnc[nH]1
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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 C16H18N4OS MW 314.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4OS/c1-11-8-16(2,3)20(13-7-5-4-6-12(11)13)14(21)9-22-15-17-10-18-19-15/h4-8,10H,9H2,1-3H3,(H,17,18,19)InChIKey
HZXSFAUJYDGYNX-UHFFFAOYSA-NSynonyms
2(1H124TRIAZOL5YLSULFANYL)1(224TRIMETHYLQUINOLIN1YL)ETHANONE
2(4H124TRIAZOL3YLSULFANYL)1(224TRIMETHYLQUINOLIN1(2H)YL)ETHANONE
2(4H124TRIAZOL3YLTHIO)1(224TRIMETHYL(12DIHYDROQUINOLYL))ETHAN1ONE
224TRIMETHYL1((4H124TRIAZOL3YLTHIO)ACETYL)12DIHYDROQUINOLINE
CC1=CC(N(C2=CC=CC=C12)C(=O)CSC3=NC=NN3)(C)C
InChI=1SC16H18N4OSc111816(23)20(13754612(11)13)14(21)922151710181915h4810H9H213H3(H171819)
MFCD00486119
O=C(N1c2ccccc2C(=CC1(C)C)C)CSc1nnc(nH)1
STK057227
ZINC000013115225
ZINC13115225
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