Vitas-M small molecule compound
2-(4-nitrophenoxy)-1-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]propan-1-one
Catalog ID
STL175142
SMILES O=C(C(Oc1ccc(cc1)[N+](=O)[O-])C)N1CCN(CC1)C(=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 C18H19N3O5S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O5S/c1-13(26-15-6-4-14(5-7-15)21(24)25)17(22)19-8-10-20(11-9-19)18(23)16-3-2-12-27-16/h2-7,12-13H,8-11H2,1H3InChIKey
PXBVZNHLFMIYCI-UHFFFAOYSA-NSynonyms
938020-93-02(4nitrophenoxy)1(4(thiophen2ylcarbonyl)piperazin1yl)propan1one
2(4nitrophenoxy)1(4(thiophene2carbonyl)piperazin1yl)propan1one
938020930
CC(C(=O)N1CCN(CC1)C(=O)C2=CC=CS2)OC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H19N3O5Sc113(26156414(5715)21(24)25)17(22)1981020(11919)18(23)1632122716h271213H811H21H3
MFCD08557412
O=C(C(Oc1ccc(cc1)(N+)(=O)(O))C)N1CCN(CC1)C(=O)c1cccs1
ZINC000020606833
ZINC000020606834
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