Vitas-M small molecule compound
4-nitrobenzyl 1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-oxopyrrolidine-3-carboxylate
Catalog ID
STK290684
SMILES CCOc1ccc2c(c1)sc(n2)N1CC(CC1=O)C(=O)OCc1ccc(cc1)[N+](=O)[O-]
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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 C21H19N3O6S MW 441.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O6S/c1-2-29-16-7-8-17-18(10-16)31-21(22-17)23-11-14(9-19(23)25)20(26)30-12-13-3-5-15(6-4-13)24(27)28/h3-8,10,14H,2,9,11-12H2,1H3InChIKey
VOGRPUXBZBTKRQ-UHFFFAOYSA-NSynonyms
(4NITROPHENYL)METHYL1(6ETHOXY13BENZOTHIAZOL2YL)5OXOPYRROLIDINE3CARBOXYLATE
4nitrobenzyl1(6ethoxy13benzothiazol2yl)5oxopyrrolidine3carboxylate
CCOC1=CC2=C(C=C1)N=C(S2)N3CC(CC3=O)C(=O)OCC4=CC=C(C=C4)(N+)(=O)(O)
CCOc1ccc2c(c1)sc(n2)N1CC(CC1=O)C(=O)OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H19N3O6Sc122916781718(1016)3121(2217)231114(919(23)25)20(26)3012133515(6413)24(27)28h381014H291112H21H3
MFCD06019016
ZINC000009591738
ZINC000009591740
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