Vitas-M small molecule compound

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

Catalog ID
STK481300
SMILES CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cccc2)c1cccnc1

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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 C25H22N4O2S MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O2S/c1-14-8-9-17-21(11-14)32-25(22(17)23(26)30)29-24(31)18-12-20(15-5-4-10-27-13-15)28-19-7-3-2-6-16(18)19/h2-7,10,12-14H,8-9,11H2,1H3,(H2,26,30)(H,29,31)
InChIKey
OXKKFMLILYWBHQ-UHFFFAOYSA-N
Synonyms

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5
InChI=1SC25H22N4O2Sc114891721(1114)3225(22(17)23(26)30)2924(31)181220(155410271315)2819732616(18)19h27101214H8911H21H3(H22630)(H2931)
MFCD08073385
N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)2(pyridin3yl)quinoline4carboxamide
N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)2pyridin3ylquinoline4carboxamide
ZINC000013321889
ZINC000013321891

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Available files

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