Vitas-M small molecule compound

(2E,5Z)-3-ethyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[5-oxo-1-phenyl-3-(phenylamino)-1,5-dihydro-4H-pyrazol-4-ylidene]-1,3-thiazolidin-4-one

Catalog ID
STL363168
SMILES CCn1/c(=C\2/C(=NN(C2=O)c2ccccc2)Nc2ccccc2)/s/c(=c/2\sc3c(n2C)cccc3)/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 C28H23N5O2S2 MW 525.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N5O2S2/c1-3-32-26(35)23(28-31(2)20-16-10-11-17-21(20)36-28)37-27(32)22-24(29-18-12-6-4-7-13-18)30-33(25(22)34)19-14-8-5-9-15-19/h4-17H,3H2,1-2H3,(H,29,30)/b27-22+,28-23-
InChIKey
RYSOXNAHYHAEOR-YJZCZVOBSA-N
Synonyms
306316-77-8
(2E5Z)2(3ANILINO5OXO1PHENYLPYRAZOL4YLIDENE)3ETHYL5(3METHYL13BENZOTHIAZOL2YLIDENE)13THIAZOLIDIN4ONE
(2E5Z)3ethyl5(3methyl13benzothiazol2(3H)ylidene)2(5oxo1phenyl3(phenylamino)15dihydro4Hpyrazol4ylidene)13thiazolidin4one
(2E5Z)3ethyl5(3methylbenzo(d)thiazol2(3H)ylidene)2(5oxo1phenyl3(phenylamino)1Hpyrazol4(5H)ylidene)thiazolidin4one
306316778
CCn1c(=C2C(=NN(C2=O)c2ccccc2)Nc2ccccc2)sc(=c2sc3c(n2C)cccc3)c1=O
CCN1C(=C2C(=NN(C2=O)C3=CC=CC=C3)NC4=CC=CC=C4)SC(=C5N(C6=CC=CC=C6S5)C)C1=O
InChI=1SC28H23N5O2S2c133226(35)23(2831(2)201610111721(20)3628)3727(32)2224(2918126471318)3033(25(22)34)19148591519h417H3H212H3(H2930)b2722+2823
MFCD00633183
ZINC000100702492
ZINC100702492

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Available files

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