Vitas-M small molecule compound
2-(3-nitrophenyl)-2-oxoethyl 2-(5-ethylthiophen-2-yl)-6,8-dimethylquinoline-4-carboxylate
Catalog ID
STK463060
SMILES CCc1ccc(s1)c1cc(C(=O)OCC(=O)c2cccc(c2)[N+](=O)[O-])c2c(n1)c(C)cc(c2)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 C26H22N2O5S MW 474.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O5S/c1-4-19-8-9-24(34-19)22-13-21(20-11-15(2)10-16(3)25(20)27-22)26(30)33-14-23(29)17-6-5-7-18(12-17)28(31)32/h5-13H,4,14H2,1-3H3InChIKey
CCADGJRPOVDEQY-UHFFFAOYSA-NSynonyms
(2(3nitrophenyl)2oxoethyl)2(5ethylthiophen2yl)68dimethylquinoline4carboxylate
2(3NITROPHENYL)2OXOETHYL2(5ETHYL(2THIENYL))68DIMETHYLQUINOLINE4CARBOXYLATE
2(3nitrophenyl)2oxoethyl2(5ethylthiophen2yl)68dimethylquinoline4carboxylate
CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)OCC(=O)C4=CC(=CC=C4)(N+)(=O)(O))C)C
CCc1ccc(s1)c1cc(C(=O)OCC(=O)c2cccc(c2)(N+)(=O)(O))c2c(n1)c(C)cc(c2)C
InChI=1SC26H22N2O5Sc14198924(3419)221321(201115(2)1016(3)25(20)2722)26(30)331423(29)1765718(1217)28(31)32h513H414H213H3
MFCD06757548
ZINC000020212951
ZINC20212951
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