Vitas-M small molecule compound

(2E)-N-(3-chlorophenyl)-2-cyano-3-[1-(naphthalen-1-ylmethyl)-1H-indol-3-yl]prop-2-enamide

Catalog ID
STK015558
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1cccc2c1cccc2)/C(=O)Nc1cccc(c1)Cl

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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 C29H20ClN3O MW 461.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20ClN3O/c30-24-10-6-11-25(16-24)32-29(34)22(17-31)15-23-19-33(28-14-4-3-13-27(23)28)18-21-9-5-8-20-7-1-2-12-26(20)21/h1-16,19H,18H2,(H,32,34)/b22-15+
InChIKey
NIUTWAJTGAYDPL-PXLXIMEGSA-N
Synonyms
402616-51-7
(2E)N(3CHLOROPHENYL)2CYANO3(1(NAPHTHALEN1YLMETHYL)1HINDOL3YL)PROP2ENAMIDE
(E)N(3CHLOROPHENYL)2CYANO3(1(NAPHTHALEN1YLMETHYL)INDOL3YL)PROP2ENAMIDE
402616517
C1=CC=C2C(=C1)C=CC=C2CN3C=C(C4=CC=CC=C43)C=C(C#N)C(=O)NC5=CC(=CC=C5)Cl
InChI=1SC29H20ClN3Oc30241061125(1624)3229(34)22(1731)15231933(2814431327(23)28)1821958207121226(20)21h11619H18H2(H3234)b2215+
MFCD02374114
N#CC(=Cc1cn(c2c1cccc2)Cc1cccc2c1cccc2)C(=O)Nc1cccc(c1)Cl
STK015558
ZINC000002775775
ZINC02775775
ZINC2775775

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.