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Vitas-M small molecule compound

N-(4-methyl-3-nitrophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide

Catalog ID
STK232138
SMILES O=C(CC1SCCNC1=O)Nc1ccc(c(c1)[N+](=O)[O-])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 C13H15N3O4S MW 309.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O4S/c1-8-2-3-9(6-10(8)16(19)20)15-12(17)7-11-13(18)14-4-5-21-11/h2-3,6,11H,4-5,7H2,1H3,(H,14,18)(H,15,17)
InChIKey
DBTJMKVLNTUMQK-UHFFFAOYSA-N
Synonyms
777869-27-9
777869279
CC1=C(C=C(C=C1)NC(=O)CC2C(=O)NCCS2)(N+)(=O)(O)
InChI=1SC13H15N3O4Sc18239(610(8)16(19)20)1512(17)71113(18)14452111h23611H457H21H3(H1418)(H1517)
MFCD06612826
N(4METHYL3NITROPHENYL)2(3OXO(14THIAZAPERHYDROIN2YL))ACETAMIDE
N(4methyl3nitrophenyl)2(3oxothiomorpholin2yl)acetamide
O=C(CC1SCCNC1=O)Nc1ccc(c(c1)(N+)(=O)(O))C
ZINC000002359816
ZINC000002359817

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Available files

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

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