Vitas-M small molecule compound

3-methyl-N-(2-oxotetrahydrothiophen-3-yl)benzamide

Catalog ID
STK049800
SMILES O=C1SCCC1NC(=O)c1cccc(c1)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 C12H13NO2S MW 235.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO2S/c1-8-3-2-4-9(7-8)11(14)13-10-5-6-16-12(10)15/h2-4,7,10H,5-6H2,1H3,(H,13,14)
InChIKey
XKMAZNFYSJPEKD-UHFFFAOYSA-N
Synonyms
321521-70-4
321521704
3METHYLN(2OXOTETRAHYDRO3THIOPHENYL)BENZENECARBOXAMIDE
3METHYLN(2OXOTETRAHYDROTHIOPHEN3YL)BENZAMIDE
3METHYLN(2OXOTHIOLAN3YL)BENZAMIDE
CC1=CC=CC(=C1)C(=O)NC2CCSC2=O
InChI=1SC12H13NO2Sc183249(78)11(14)1310561612(10)15h24710H56H21H3(H1314)
MFCD00784157
O=C1SCCC1NC(=O)c1cccc(c1)C
STK049800
ZINC000000247524
ZINC000000247529

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Available files

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