ethyl 4-[1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H32N4O5S MolecularWeight: 452.56758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H32N4O5S/c1-3-30-21(27)24-15-13-23(14-16-24)17(2)20(26)22-18-7-9-19(10-8-18)31(28,29)25-11-5-4-6-12-25/h7-10,17H,3-6,11-16H2,1-2H3,(H,22,26)