ethyl 4-[2-[methylsulfonyl-(4-propan-2-ylphenyl)amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[methylsulfonyl-(4-propan-2-ylphenyl)amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4-isopropyl-N-methylsulfonyl-anilino)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(N-methylsulfonyl-4-propan-2-ylanilino)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(N-methylsulfonyl-4-propan-2-ylanilino)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-isopropyl-N-mesyl-anilino)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H29N3O5S MolecularWeight: 411.51566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C

InChI

InChI=1S/C19H29N3O5S/c1-5-27-19(24)21-12-10-20(11-13-21)18(23)14-22(28(4,25)26)17-8-6-16(7-9-17)15(2)3/h6-9,15H,5,10-14H2,1-4H3