Vitas-M small molecule compound

N-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1-benzothiophene-2-carboxamide

Catalog ID
STK736840
SMILES O=C1COc2c(N1)cc(cc2)NC(=O)c1cc2c(s1)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 C17H12N2O3S MW 324.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O3S/c20-16-9-22-13-6-5-11(8-12(13)19-16)18-17(21)15-7-10-3-1-2-4-14(10)23-15/h1-8H,9H2,(H,18,21)(H,19,20)
InChIKey
SCDBZZJNPZDVEB-UHFFFAOYSA-N
Synonyms

C1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C3=CC4=CC=CC=C4S3
InChI=1SC17H12N2O3Sc2016922136511(812(13)1916)1817(21)15710312414(10)2315h18H9H2(H1821)(H1920)
MFCD09064719
N(3oxo34dihydro2H14benzoxazin6yl)1benzothiophene2carboxamide
N(3oxo4H14benzoxazin6yl)1benzothiophene2carboxamide
ZINC000012360317
ZINC12360317

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Available files

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