Vitas-M small molecule compound

methyl 3-{[(4-nitrophenyl)acetyl]amino}thiophene-2-carboxylate

Catalog ID
STK435418
SMILES COC(=O)c1sccc1NC(=O)Cc1ccc(cc1)[N+](=O)[O-]

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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 C14H12N2O5S MW 320.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O5S/c1-21-14(18)13-11(6-7-22-13)15-12(17)8-9-2-4-10(5-3-9)16(19)20/h2-7H,8H2,1H3,(H,15,17)
InChIKey
NHZISDWHSYKOCR-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(C=CS1)NC(=O)CC2=CC=C(C=C2)(N+)(=O)(O)
COC(=O)c1sccc1NC(=O)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC14H12N2O5Sc12114(18)1311(672213)1512(17)892410(539)16(19)20h27H8H21H3(H1517)
METHYL3(((4NITROPHENYL)ACETYL)AMINO)2THIOPHENECARBOXYLATE
methyl3(((4nitrophenyl)acetyl)amino)thiophene2carboxylate
METHYL3((2(4NITROPHENYL)ACETYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL3(2(4NITROPHENYL)ACETYLAMINO)THIOPHENE2CARBOXYLATE
MFCD03378153
ZINC000000370199
ZINC00370199
ZINC370199

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Available files

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