Vitas-M small molecule compound
(2E,5Z)-3-benzyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)-1,3-thiazolidin-4-one
Catalog ID
STK368309
SMILES Cn1/c(=c\2/s/c(=C/3\C(=NN(C3=O)c3ccccc3)C)/n(c2=O)Cc2ccccc2)/sc2c1cccc2
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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 C28H22N4O2S2 MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O2S2/c1-18-23(25(33)32(29-18)20-13-7-4-8-14-20)27-31(17-19-11-5-3-6-12-19)26(34)24(36-27)28-30(2)21-15-9-10-16-22(21)35-28/h3-16H,17H2,1-2H3/b27-23+,28-24-InChIKey
BOHMVTQGCXKDBB-YFMKTMAWSA-NSynonyms
(2E5Z)3benzyl5(3methyl13benzothiazol2(3H)ylidene)2(3methyl5oxo1phenyl15dihydro4Hpyrazol4ylidene)13thiazolidin4one
(2E5Z)3BENZYL5(3METHYL13BENZOTHIAZOL2YLIDENE)2(3METHYL5OXO1PHENYLPYRAZOL4YLIDENE)13THIAZOLIDIN4ONE
5(3METHYL(3HYDROBENZOTHIAZOL2YLIDENE))2(3METHYL5OXO1PHENYL(12DIAZOLIN4YLIDENE))3BENZYL13THIAZOLIDIN4ONE
CC1=NN(C(=O)C1=C2N(C(=O)C(=C3N(C4=CC=CC=C4S3)C)S2)CC5=CC=CC=C5)C6=CC=CC=C6
Cn1c(=c2sc(=C3C(=NN(C3=O)c3ccccc3)C)n(c2=O)Cc2ccccc2)sc2c1cccc2
InChI=1SC28H22N4O2S2c11823(25(33)32(2918)20137481420)2731(1719115361219)26(34)24(3627)2830(2)21159101622(21)3528h316H17H212H3b2723+2824
MFCD03648623
ZINC000102101080
ZINC102101080
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