Vitas-M small molecule compound

propyl 4,5-dimethyl-2-{[(4-nitrophenoxy)acetyl]amino}thiophene-3-carboxylate

Catalog ID
STK452390
SMILES CCCOC(=O)c1c(NC(=O)COc2ccc(cc2)[N+](=O)[O-])sc(c1C)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 C18H20N2O6S MW 392.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O6S/c1-4-9-25-18(22)16-11(2)12(3)27-17(16)19-15(21)10-26-14-7-5-13(6-8-14)20(23)24/h5-8H,4,9-10H2,1-3H3,(H,19,21)
InChIKey
GARHSMPHOJGYPO-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC2=CC=C(C=C2)(N+)(=O)(O)
CCCOC(=O)c1c(NC(=O)COc2ccc(cc2)(N+)(=O)(O))sc(c1C)C
InChI=1SC18H20N2O6Sc1492518(22)1611(2)12(3)2717(16)1915(21)1026147513(6814)20(23)24h58H4910H213H3(H1921)
MFCD02607011
PROPYL2(((4NITROPHENOXY)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
propyl45dimethyl2(((4nitrophenoxy)acetyl)amino)thiophene3carboxylate
PROPYL45DIMETHYL2((2(4NITROPHENOXY)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
PROPYL45DIMETHYL2(2(4NITROPHENOXY)ACETYLAMINO)THIOPHENE3CARBOXYLATE
ZINC000002090898
ZINC02090898
ZINC2090898

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Available files

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