Vitas-M small molecule compound

N-[3-cyano-4-(2,4-dichlorophenyl)thiophen-2-yl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide

Catalog ID
STK427017
SMILES N#Cc1c(scc1c1ccc(cc1Cl)Cl)NC(=O)c1cc(nc2c1cccc2)c1ccc(c(c1)C)C

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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 C29H19Cl2N3OS MW 528.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H19Cl2N3OS/c1-16-7-8-18(11-17(16)2)27-13-22(21-5-3-4-6-26(21)33-27)28(35)34-29-23(14-32)24(15-36-29)20-10-9-19(30)12-25(20)31/h3-13,15H,1-2H3,(H,34,35)
InChIKey
DLSCYJJQBUDSAV-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=C(C=C(C=C5)Cl)Cl)C#N)C
InChI=1SC29H19Cl2N3OSc1167818(1117(16)2)271322(21534626(21)3327)28(35)342923(1432)24(153629)2010919(30)1225(20)31h31315H12H3(H3435)
MFCD02612402
N(3CYANO4(24DICHLOROPHENYL)2THIENYL)2(34DIMETHYLPHENYL)4QUINOLINECARBOXAMIDE
N(3cyano4(24dichlorophenyl)thiophen2yl)2(34dimethylphenyl)quinoline4carboxamide
N(4(24DICHLOROPHENYL)3CYANO(2THIENYL))(2(34DIMETHYLPHENYL)(4QUINOLYL))CARBOXAMIDE
ZINC000002108175
ZINC02108175
ZINC2108175

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Available files

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