Vitas-M small molecule compound

N-[(2-nitrophenyl)carbamothioyl]-4-(propan-2-yloxy)benzamide

Catalog ID
STK050964
SMILES CC(Oc1ccc(cc1)C(=O)NC(=S)Nc1ccccc1[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 C17H17N3O4S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S/c1-11(2)24-13-9-7-12(8-10-13)16(21)19-17(25)18-14-5-3-4-6-15(14)20(22)23/h3-11H,1-2H3,(H2,18,19,21,25)
InChIKey
OVHCBNKWBULYLQ-UHFFFAOYSA-N
Synonyms

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2(N+)(=O)(O)
CC(Oc1ccc(cc1)C(=O)NC(=S)Nc1ccccc1(N+)(=O)(O))C
InChI=1SC17H17N3O4Sc111(2)24139712(81013)16(21)1917(25)1814534615(14)20(22)23h311H12H3(H218192125)
MFCD02627013
N((2NITROPHENYL)CARBAMOTHIOYL)4(PROPAN2YLOXY)BENZAMIDE
N((2NITROPHENYL)CARBAMOTHIOYL)4PROPAN2YLOXYBENZAMIDE
STK050964
ZINC000004701815
ZINC04701815
ZINC4701815

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Available files

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