Vitas-M small molecule compound
2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl 2-(thiophen-2-yl)quinoline-4-carboxylate
Catalog ID
STK290432
SMILES O=C(c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-])COC(=O)c1cc(nc2c1cccc2)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 C28H18N2O6S MW 510.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H18N2O6S/c31-26(18-7-11-20(12-8-18)36-21-13-9-19(10-14-21)30(33)34)17-35-28(32)23-16-25(27-6-3-15-37-27)29-24-5-2-1-4-22(23)24/h1-16H,17H2InChIKey
XXMPRLGSZNTSDF-UHFFFAOYSA-NSynonyms
(2(4(4nitrophenoxy)phenyl)2oxoethyl)2thiophen2ylquinoline4carboxylate
2(4(4nitrophenoxy)phenyl)2oxoethyl2(thiophen2yl)quinoline4carboxylate
C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)OCC(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC28H18N2O6Sc3126(1871120(12818)362113919(101421)30(33)34)173528(32)231625(2763153727)2924521422(23)24h116H17H2
MFCD06194617
O=C(c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O))COC(=O)c1cc(nc2c1cccc2)c1cccs1
ZINC000009591005
ZINC09591005
ZINC9591005
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