Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL049756
SMILES CCOc1ccc(cc1)C1/C(=C(/c2ccc(c(c2)C)OC)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)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 C30H28N2O5S MW 528.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O5S/c1-6-37-21-10-7-19(8-11-21)26-24(27(33)20-9-12-22(36-5)17(3)15-20)28(34)29(35)32(26)30-31-25-18(4)13-16(2)14-23(25)38-30/h7-15,26,33H,6H2,1-5H3/b27-24+InChIKey
NYKOSYMYXAKJEZ-SOYKGTTHSA-NSynonyms
618418-69-2(4E)1(46dimethyl13benzothiazol2yl)5(4ethoxyphenyl)4(hydroxy(4methoxy3methylphenyl)methylidene)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)5(4ETHOXYPHENYL)3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
618418692
CCOC1=CC=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OC)C)O)C(=O)C(=O)N2C4=NC5=C(C=C(C=C5S4)C)C
CCOc1ccc(cc1)C1C(=C(c2ccc(c(c2)C)OC)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
InChI=1SC30H28N2O5Sc16372110719(81121)2624(27(33)2091222(365)17(3)1520)28(34)29(35)32(26)30312518(4)1316(2)1423(25)3830h7152633H6H215H3b2724+
MFCD05726243
ZINC000102885631
ZINC000102885633
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