Vitas-M small molecule compound

N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,4-dichlorophenyl)-3-methylquinoline-4-carboxamide

Catalog ID
STK419255
SMILES Clc1ccc(c(c1)Cl)c1nc2ccccc2c(c1C)C(=O)Nc1sc2c(c1C(=O)N)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 C26H21Cl2N3O2S MW 510.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl2N3O2S/c1-13-21(25(33)31-26-22(24(29)32)17-7-3-5-9-20(17)34-26)16-6-2-4-8-19(16)30-23(13)15-11-10-14(27)12-18(15)28/h2,4,6,8,10-12H,3,5,7,9H2,1H3,(H2,29,32)(H,31,33)
InChIKey
QEKUHMRGHHNART-UHFFFAOYSA-N
Synonyms

CC1=C(C2=CC=CC=C2N=C1C3=C(C=C(C=C3)Cl)Cl)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)N
InChI=1SC26H21Cl2N3O2Sc11321(25(33)312622(24(29)32)17735920(17)3426)16624819(16)3023(13)15111014(27)1218(15)28h24681012H3579H21H3(H22932)(H3133)
MFCD01356194
N(3carbamoyl4567tetrahydro1benzothiophen2yl)2(24dichlorophenyl)3methylquinoline4carboxamide
ZINC000002742032
ZINC02742032
ZINC2742032

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Available files

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