Vitas-M small molecule compound
2-[5-(4-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1-(thiomorpholin-4-yl)ethanone
Catalog ID
STL309781
SMILES Clc1ccc(cc1)c1[nH]nc(c1CC(=O)N1CCSCC1)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 C16H18ClN3OS MW 335.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN3OS/c1-11-14(10-15(21)20-6-8-22-9-7-20)16(19-18-11)12-2-4-13(17)5-3-12/h2-5H,6-10H2,1H3,(H,18,19)InChIKey
LWEOMVOXFQWSRT-UHFFFAOYSA-NSynonyms
1489260-00-51489260005
2(3(4chlorophenyl)5methyl1Hpyrazol4yl)1thiomorpholin4ylethanone
2(3(4chlorophenyl)5methyl1Hpyrazol4yl)1thiomorpholinoethanone
2(5(4chlorophenyl)3methyl1Hpyrazol4yl)1(thiomorpholin4yl)ethanone
CC1=C(C(=NN1)C2=CC=C(C=C2)Cl)CC(=O)N3CCSCC3
Clc1ccc(cc1)c1(nH)nc(c1CC(=O)N1CCSCC1)C
Clc1ccc(cc1)c1n(nH)c(c1CC(=O)N1CCSCC1)C
InChI=1SC16H18ClN3OSc11114(1015(21)2068229720)16(191811)122413(17)5312h25H610H21H3(H1819)
MFCD28025147
ZINC000095472860
ZINC95472860
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