Vitas-M small molecule compound

(2Z)-3-(1-benzyl-2-methyl-1H-indol-3-yl)-2-cyano-N-(naphthalen-2-yl)prop-2-enamide

Catalog ID
STK182456
SMILES N#C/C(=C/c1c2ccccc2n(c1C)Cc1ccccc1)/C(=O)Nc1ccc2c(c1)cccc2

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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 C30H23N3O MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N3O/c1-21-28(27-13-7-8-14-29(27)33(21)20-22-9-3-2-4-10-22)18-25(19-31)30(34)32-26-16-15-23-11-5-6-12-24(23)17-26/h2-18H,20H2,1H3,(H,32,34)/b25-18-
InChIKey
GJPGCRUGJIUNHI-BWAHOGKJSA-N
Synonyms

(2Z)2CYANO3(2METHYL1BENZYLINDOL3YL)N(2NAPHTHYL)PROP2ENAMIDE
(2Z)3(1BENZYL2METHYL1HINDOL3YL)2CYANON(NAPHTHALEN2YL)PROP2ENAMIDE
(Z)3(1BENZYL2METHYLINDOL3YL)2CYANONNAPHTHALEN2YLPROP2ENAMIDE
CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)C=C(C#N)C(=O)NC4=CC5=CC=CC=C5C=C4
InChI=1SC30H23N3Oc12128(2713781429(27)33(21)202293241022)1825(1931)30(34)322616152311561224(23)1726h218H20H21H3(H3234)b2518
MFCD02067085
N#CC(=Cc1c2ccccc2n(c1C)Cc1ccccc1)C(=O)Nc1ccc2c(c1)cccc2
ZINC000004047938
ZINC04047938
ZINC4047938

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Available files

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