ethyl 4-[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2S)-4-methyl-2-(p-tolylsulfonylamino)pentanoyl]piperazine-1-carboxylate CAS Name: 4-[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxopentyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]piperazine-1-carboxylate Traditional Name: 4-[(2S)-4-methyl-2-(tosylamino)pentanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CC(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)[C@H](CC(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H31N3O5S/c1-5-28-20(25)23-12-10-22(11-13-23)19(24)18(14-15(2)3)21-29(26,27)17-8-6-16(4)7-9-17/h6-9,15,18,21H,5,10-14H2,1-4H3/t18-/m0/s1