ethyl 4-[[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[3-[(4-ethyl-1-piperazinyl)sulfonyl]anilino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[3-(4-ethylpiperazino)sulfonylphenyl]carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H32N4O5S MolecularWeight: 452.56758

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C21H32N4O5S/c1-3-23-12-14-25(15-13-23)31(28,29)19-7-5-6-18(16-19)22-20(26)17-8-10-24(11-9-17)21(27)30-4-2/h5-7,16-17H,3-4,8-15H2,1-2H3,(H,22,26)