ethyl 4-[2-[cyclohexyl(phenylsulfonyl)amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[cyclohexyl(phenylsulfonyl)amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[benzenesulfonyl(cyclohexyl)amino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[benzenesulfonyl(cyclohexyl)amino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[benzenesulfonyl(cyclohexyl)amino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[besyl(cyclohexyl)amino]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN(C2CCCCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN(C2CCCCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H31N3O5S/c1-2-29-21(26)23-15-13-22(14-16-23)20(25)17-24(18-9-5-3-6-10-18)30(27,28)19-11-7-4-8-12-19/h4,7-8,11-12,18H,2-3,5-6,9-10,13-17H2,1H3