Vitas-M small molecule compound
{4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}[4-(thiophen-2-ylsulfonyl)piperazin-1-yl]methanone
Catalog ID
STL403029
SMILES O=C(c1ccc(cc1)Cn1cc(c(n1)[N+](=O)[O-])Cl)N1CCN(CC1)S(=O)(=O)c1cccs1
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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 C19H18ClN5O5S2 MW 495.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN5O5S2/c20-16-13-23(21-18(16)25(27)28)12-14-3-5-15(6-4-14)19(26)22-7-9-24(10-8-22)32(29,30)17-2-1-11-31-17/h1-6,11,13H,7-10,12H2InChIKey
OPABWNVVYXACLX-UHFFFAOYSA-NSynonyms
1005689-25-7(4((4chloro3nitro1Hpyrazol1yl)methyl)phenyl)(4(thiophen2ylsulfonyl)piperazin1yl)methanone
(4((4chloro3nitropyrazol1yl)methyl)phenyl)(4thiophen2ylsulfonylpiperazin1yl)methanone
1005689257
C1CN(CCN1C(=O)C2=CC=C(C=C2)CN3C=C(C(=N3)(N+)(=O)(O))Cl)S(=O)(=O)C4=CC=CS4
InChI=1SC19H18ClN5O5S2c20161323(2118(16)25(27)28)12143515(6414)19(26)227924(10822)32(2930)1721113117h161113H71012H2
MFCD04138075
O=C(c1ccc(cc1)Cn1cc(c(n1)(N+)(=O)(O))Cl)N1CCN(CC1)S(=O)(=O)c1cccs1
ZINC000002809560
ZINC02809560
ZINC2809560
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