ethyl 4-[[3-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-1-benzofuran-2-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[3-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-1-benzofuran-2-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-methyl-5-[(4-methyl-1-piperidyl)sulfonyl]benzofuran-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-methyl-5-[(4-methyl-1-piperidinyl)sulfonyl]-2-benzofuranyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-1-benzofuran-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-methyl-5-(4-methylpiperidino)sulfonyl-benzofuran-2-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H31N3O6S MolecularWeight: 477.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCC(CC4)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCC(CC4)C)C

InChI

InChI=1S/C23H31N3O6S/c1-4-31-23(28)25-13-11-24(12-14-25)22(27)21-17(3)19-15-18(5-6-20(19)32-21)33(29,30)26-9-7-16(2)8-10-26/h5-6,15-16H,4,7-14H2,1-3H3