Vitas-M small molecule compound

ethyl 5-{[({3-[(3-nitrophenyl)carbamoyl]phenyl}sulfonyl)amino]methyl}furan-2-carboxylate

Catalog ID
STK769395
SMILES CCOC(=O)c1ccc(o1)CNS(=O)(=O)c1cccc(c1)C(=O)Nc1cccc(c1)[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 C21H19N3O8S MW 473.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O8S/c1-2-31-21(26)19-10-9-17(32-19)13-22-33(29,30)18-8-3-5-14(11-18)20(25)23-15-6-4-7-16(12-15)24(27)28/h3-12,22H,2,13H2,1H3,(H,23,25)
InChIKey
CBAAJPXNIQPJLD-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(O1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=CC=C3)(N+)(=O)(O)
CCOC(=O)c1ccc(o1)CNS(=O)(=O)c1cccc(c1)C(=O)Nc1cccc(c1)(N+)(=O)(O)
ethyl5((((3((3nitrophenyl)carbamoyl)phenyl)sulfonyl)amino)methyl)furan2carboxylate
ETHYL5((((3(N(3NITROPHENYL)CARBAMOYL)PHENYL)SULFONYL)AMINO)METHYL)FURAN2CARBOXYLATE
ETHYL5(((3((3NITROPHENYL)CARBAMOYL)PHENYL)SULFONYLAMINO)METHYL)FURAN2CARBOXYLATE
InChI=1SC21H19N3O8Sc123121(26)1910917(3219)132233(2930)1883514(1118)20(25)231564716(1215)24(27)28h31222H213H21H3(H2325)
MFCD03409003
ZINC000003621133
ZINC03621133
ZINC3621133

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Available files

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