Vitas-M small molecule compound

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

Catalog ID
STL043774
SMILES Clc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\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 C27H21ClN2O3S MW 488.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21ClN2O3S/c1-14-4-6-18(7-5-14)24(31)21-23(17-8-10-19(28)11-9-17)30(26(33)25(21)32)27-29-22-16(3)12-15(2)13-20(22)34-27/h4-13,23,31H,1-3H3/b24-21+
InChIKey
UGUCJSCFQKVQNC-DARPEHSRSA-N
Synonyms
514193-65-8
(4E)5(4chlorophenyl)1(46dimethyl13benzothiazol2yl)4(hydroxy(4methylphenyl)methylidene)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)5(4CHLOROPHENYL)3HYDROXY4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
514193658
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(C=C(C=C4S3)C)C)C5=CC=C(C=C5)Cl)O
Clc1ccc(cc1)C1C(=C(c2ccc(cc2)C)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
InChI=1SC27H21ClN2O3Sc1144618(7514)24(31)2123(1781019(28)11917)30(26(33)25(21)32)27292216(3)1215(2)1320(22)3427h4132331H13H3b2421+
MFCD03802632
ZINC000102873523
ZINC000102873525

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Available files

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