Vitas-M small molecule compound

(2E)-N-benzyl-3-[1-(4-chlorophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]-2-cyanoprop-2-enamide

Catalog ID
STK186503
SMILES N#C/C(=C\c1cc(n(c1c1ccccc1)c1ccc(cc1)Cl)c1ccccc1)/C(=O)NCc1ccccc1

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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 C33H24ClN3O MW 514.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24ClN3O/c34-29-16-18-30(19-17-29)37-31(25-12-6-2-7-13-25)21-27(32(37)26-14-8-3-9-15-26)20-28(22-35)33(38)36-23-24-10-4-1-5-11-24/h1-21H,23H2,(H,36,38)/b28-20+
InChIKey
KHCIHGYNILJKMU-VFCFBJKWSA-N
Synonyms

(2E)NBENZYL3(1(4CHLOROPHENYL)25DIPHENYL1HPYRROL3YL)2CYANOPROP2ENAMIDE
(E)Nbenzyl3(1(4chlorophenyl)25diphenylpyrrol3yl)2cyanoprop2enamide
C1=CC=C(C=C1)CNC(=O)C(=CC2=C(N(C(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C5=CC=CC=C5)C#N
InChI=1SC33H24ClN3Oc3429161830(191729)3731(25126271325)2127(32(37)26148391526)2028(2235)33(38)362324104151124h121H23H2(H3638)b2820+
MFCD02378989
N#CC(=Cc1cc(n(c1c1ccccc1)c1ccc(cc1)Cl)c1ccccc1)C(=O)NCc1ccccc1
ZINC000009907437
ZINC09907437
ZINC9907437

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Available files

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