Vitas-M small molecule compound

(2E)-2-cyano-3-[1-(2,3-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-N-(thiophen-2-ylmethyl)prop-2-enamide

Catalog ID
STK107573
SMILES N#C/C(=C\c1cc(n(c1C)c1cccc(c1Cl)Cl)C)/C(=O)NCc1cccs1

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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 C21H17Cl2N3OS MW 430.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N3OS/c1-13-9-15(14(2)26(13)19-7-3-6-18(22)20(19)23)10-16(11-24)21(27)25-12-17-5-4-8-28-17/h3-10H,12H2,1-2H3,(H,25,27)/b16-10+
InChIKey
WLJKCIPBKWOQHS-MHWRWJLKSA-N
Synonyms

(2E)2CYANO3(1(23DICHLOROPHENYL)25DIMETHYL1HPYRROL3YL)N(THIOPHEN2YLMETHYL)PROP2ENAMIDE
(2E)3(1(23DICHLOROPHENYL)25DIMETHYLPYRROL3YL)2CYANON(2THIENYLMETHYL)PROP2ENAMIDE
(E)2CYANO3(1(23DICHLOROPHENYL)25DIMETHYLPYRROL3YL)N(THIOPHEN2YLMETHYL)PROP2ENAMIDE
CC1=CC(=C(N1C2=C(C(=CC=C2)Cl)Cl)C)C=C(C#N)C(=O)NCC3=CC=CS3
InChI=1SC21H17Cl2N3OSc113915(14(2)26(13)1973618(22)20(19)23)1016(1124)21(27)2512175482817h310H12H212H3(H2527)b1610+
MFCD02195592
N#CC(=Cc1cc(n(c1C)c1cccc(c1Cl)Cl)C)C(=O)NCc1cccs1
ZINC000004083449
ZINC04083449
ZINC4083449

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Available files

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