Vitas-M small molecule compound
(2E,5Z)-3-benzyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-(3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)-1,3-thiazolidin-4-one
Catalog ID
STK368313
SMILES COc1ccc2c(c1)n(C)/c(=c\1/s/c(=C/3\C(=NNC3=O)C)/n(c1=O)Cc1ccccc1)/s2
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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 C23H20N4O3S2 MW 464.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O3S2/c1-13-18(20(28)25-24-13)22-27(12-14-7-5-4-6-8-14)21(29)19(32-22)23-26(2)16-11-15(30-3)9-10-17(16)31-23/h4-11H,12H2,1-3H3,(H,25,28)/b22-18+,23-19-InChIKey
JIKVQKQIJTUXRO-YLRGQORSSA-NSynonyms
(2E5Z)3benzyl5(5methoxy3methyl13benzothiazol2(3H)ylidene)2(3methyl5oxo15dihydro4Hpyrazol4ylidene)13thiazolidin4one
(2E5Z)3benzyl5(5methoxy3methyl13benzothiazol2ylidene)2(3methyl5oxo1Hpyrazol4ylidene)13thiazolidin4one
5(5METHOXY3METHYL(3HYDROBENZOTHIAZOL2YLIDENE))2(3METHYL5OXO(12DIAZOLIN4YLIDENE))3BENZYL13THIAZOLIDIN4ONE
CC1=NNC(=O)C1=C2N(C(=O)C(=C3N(C4=C(S3)C=CC(=C4)OC)C)S2)CC5=CC=CC=C5
COc1ccc2c(c1)n(C)c(=c1sc(=C3C(=NNC3=O)C)n(c1=O)Cc1ccccc1)s2
InChI=1SC23H20N4O3S2c11318(20(28)252413)2227(12147546814)21(29)19(3222)2326(2)161115(303)91017(16)3123h411H12H213H3(H2528)b2218+2319
MFCD03648627
ZINC000057296860
ZINC57296860
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