Vitas-M small molecule compound

3-{4-[(5Z)-5-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}propanenitrile

Catalog ID
STL005839
SMILES N#CCCN1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)Cl)/S1

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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 C21H18Cl2N4O2S MW 461.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N4O2S/c22-16-4-2-14(12-17(16)23)18-5-3-15(29-18)13-19-20(28)25-21(30-19)27-10-8-26(9-11-27)7-1-6-24/h2-5,12-13H,1,7-11H2/b19-13-
InChIKey
RZGFKXLWMBBAQZ-UYRXBGFRSA-N
Synonyms
848219-74-9
(Z)3(4(5((5(34dichlorophenyl)furan2yl)methylene)4oxo45dihydrothiazol2yl)piperazin1yl)propanenitrile
3(4((5Z)5((5(34DICHLOROPHENYL)FURAN2YL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERAZIN1YL)PROPANENITRILE
3(4((5Z)5((5(34dichlorophenyl)furan2yl)methylidene)4oxo45dihydro13thiazol2yl)piperazin1yl)propanenitrile
848219749
C1CN(CCN1CCC#N)C2=NC(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)Cl)S2
InChI=1SC21H18Cl2N4O2Sc22164214(1217(16)23)185315(2918)131920(28)2521(3019)2710826(91127)71624h251213H1711H2b1913
MFCD04189658
N#CCCN1CCN(CC1)C1=NC(=O)C(=Cc2ccc(o2)c2ccc(c(c2)Cl)Cl)S1
ZINC000020440363
ZINC20440363

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Available files

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