ethyl 5-[4-[3-(dimethylamino)phenyl]carbonylpiperazin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-[3-(dimethylamino)phenyl]carbonylpiperazin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[4-[3-(dimethylamino)benzoyl]piperazin-1-yl]sulfonylfuran-2-carboxylate CAS Name: 5-[[4-[[3-(dimethylamino)phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[3-(dimethylamino)benzoyl]piperazin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-[3-(dimethylamino)benzoyl]piperazino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)N(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)N(C)C

InChI

InChI=1S/C20H25N3O6S/c1-4-28-20(25)17-8-9-18(29-17)30(26,27)23-12-10-22(11-13-23)19(24)15-6-5-7-16(14-15)21(2)3/h5-9,14H,4,10-13H2,1-3H3