Vitas-M small molecule compound

2-(3-bromophenyl)-N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide

Catalog ID
STK419181
SMILES CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)Br

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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 C26H22BrN3O2S MW 520.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22BrN3O2S/c1-14-9-10-18-22(11-14)33-26(23(18)24(28)31)30-25(32)19-13-21(15-5-4-6-16(27)12-15)29-20-8-3-2-7-17(19)20/h2-8,12-14H,9-11H2,1H3,(H2,28,31)(H,30,32)
InChIKey
PDCCQQSWDLICSQ-UHFFFAOYSA-N
Synonyms
352688-11-0
2(3bromophenyl)N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)quinoline4carboxamide
352688110
CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br
InChI=1SC26H22BrN3O2Sc1149101822(1114)3326(23(18)24(28)31)3025(32)191321(1554616(27)1215)2920832717(19)20h281214H911H21H3(H22831)(H3032)
MFCD01356064
ZINC000002083773
ZINC000002083774

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Available files

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