Vitas-M small molecule compound
(E)-{2-(4-tert-butylphenyl)-1-[3-(diethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Catalog ID
STL038578
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2sc(nc2C)C)/[O-])/C1c1ccc(cc1)C(C)(C)C)CC
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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 C27H37N3O3S MW 483.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H37N3O3S/c1-8-29(9-2)15-10-16-30-22(19-11-13-20(14-12-19)27(5,6)7)21(24(32)26(30)33)23(31)25-17(3)28-18(4)34-25/h11-14,22,31H,8-10,15-16H2,1-7H3/b23-21+InChIKey
IEQPEAWYQZFFMO-XTQSDGFTSA-NSynonyms
(E)(2(4tertbutylphenyl)1(3(diethylammonio)propyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2sc(nc2C)C)(O))C1c1ccc(cc1)C(C)(C)C)CC
MFCD18247658
ZINC000102861798
ZINC000102861801
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