Vitas-M small molecule compound

(4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-5-(4-ethoxyphenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione

Catalog ID
STL149790
SMILES CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

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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 C27H21ClN2O5S MW 520.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClN2O5S/c1-3-35-18-10-6-15(7-11-18)23-22(24(31)16-4-8-17(28)9-5-16)25(32)26(33)30(23)27-29-20-13-12-19(34-2)14-21(20)36-27/h4-14,23,31H,3H2,1-2H3/b24-22+
InChIKey
UVBZQBPLRATORX-ZNTNEXAZSA-N
Synonyms
514187-12-3
(4E)4((4chlorophenyl)(hydroxy)methylidene)5(4ethoxyphenyl)1(6methoxy13benzothiazol2yl)pyrrolidine23dione
(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)5(4ETHOXYPHENYL)1(6METHOXY13BENZOTHIAZOL2YL)PYRROLIDINE23DIONE
4((4CHLOROPHENYL)CARBONYL)5(4ETHOXYPHENYL)3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)3PYRROLIN2ONE
514187123
CCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)OC
CCOc1ccc(cc1)C1C(=C(c2ccc(cc2)Cl)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC
InChI=1SC27H21ClN2O5Sc13351810615(71118)2322(24(31)164817(28)9516)25(32)26(33)30(23)272920131219(342)1421(20)3627h4142331H3H212H3b2422+
MFCD03802383
ZINC000102929315
ZINC000102929318

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Available files

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