Vitas-M small molecule compound
(4E)-5-(4-chlorophenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK562008
SMILES CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)Cl)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=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 C27H21ClN2O4S MW 504.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClN2O4S/c1-3-34-19-12-13-20-21(14-19)35-27(29-20)30-23(16-8-10-18(28)11-9-16)22(25(32)26(30)33)24(31)17-6-4-15(2)5-7-17/h4-14,23,31H,3H2,1-2H3/b24-22+InChIKey
ZHIICVXSPNNISA-ZNTNEXAZSA-NSynonyms
514192-73-5(4E)5(4chlorophenyl)1(6ethoxy13benzothiazol2yl)4(hydroxy(4methylphenyl)methylidene)pyrrolidine23dione
5(4CHLOROPHENYL)1(6ETHOXYBENZOTHIAZOL2YL)3HYDROXY4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
514192735
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)C)O)C(=O)C3=O)C5=CC=C(C=C5)Cl
CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)Cl)C(=C(c2ccc(cc2)C)O)C(=O)C1=O
InChI=1SC27H21ClN2O4Sc13341912132021(1419)3527(2920)3023(1681018(28)11916)22(25(32)26(30)33)24(31)176415(2)5717h4142331H3H212H3b2422+
MFCD03818841
ZINC000102508951
ZINC000102508962
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