Vitas-M small molecule compound
4-[(E)-{1-[3-(dimethylamino)propyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(hydroxy)methyl]-N,N-dimethylbenzenesulfonamide
Catalog ID
STK603984
SMILES CN(CCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)S(=O)(=O)N(C)C)/O)/C1c1cccs1)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 C22H27N3O5S2 MW 477.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O5S2/c1-23(2)12-6-13-25-19(17-7-5-14-31-17)18(21(27)22(25)28)20(26)15-8-10-16(11-9-15)32(29,30)24(3)4/h5,7-11,14,19,26H,6,12-13H2,1-4H3/b20-18+InChIKey
UEVJSDYCGBLCGB-CZIZESTLSA-NSynonyms
4((E)(1(3(dimethylamino)propyl)45dioxo2(thiophen2yl)pyrrolidin3ylidene)(hydroxy)methyl)NNdimethylbenzenesulfonamide
4((E)(1(3(DIMETHYLAMINO)PROPYL)45DIOXO2THIOPHEN2YLPYRROLIDIN3YLIDENE)HYDROXYMETHYL)NNDIMETHYLBENZENESULFONAMIDE
CN(C)CCCN1C(C(=C(C2=CC=C(C=C2)S(=O)(=O)N(C)C)O)C(=O)C1=O)C3=CC=CS3
CN(CCCN1C(=O)C(=O)C(=C(c2ccc(cc2)S(=O)(=O)N(C)C)O)C1c1cccs1)C
InChI=1SC22H27N3O5S2c123(2)126132519(1775143117)18(21(27)22(25)28)20(26)1581016(11915)32(2930)24(3)4h5711141926H61213H214H3b2018+
MFCD08732852
ZINC000008738639
ZINC000008738640
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