Vitas-M small molecule compound

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

Catalog ID
STK334512
SMILES CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cccc2)c1ccc(o1)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 C25H23N3O3S MW 445.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O3S/c1-13-7-9-16-21(11-13)32-25(22(16)23(26)29)28-24(30)17-12-19(20-10-8-14(2)31-20)27-18-6-4-3-5-15(17)18/h3-6,8,10,12-13H,7,9,11H2,1-2H3,(H2,26,29)(H,28,30)
InChIKey
QRDDBWUURCHYTM-UHFFFAOYSA-N
Synonyms

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(O5)C
InChI=1SC25H23N3O3Sc113791621(1113)3225(22(16)23(26)29)2824(30)171219(2010814(2)3120)2718643515(17)18h368101213H7911H212H3(H22629)(H2830)
MFCD03385144
N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)2(5methylfuran2yl)quinoline4carboxamide
ZINC000000652477
ZINC000000652480

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Available files

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