tert-butyl 4-[2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(2-methyl-N-methylsulfonyl-anilino)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(2-methyl-N-methylsulfonylanilino)-1-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(2-methyl-N-methylsulfonylanilino)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(N-mesyl-2-methyl-anilino)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H29N3O5S MolecularWeight: 411.51566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)N2CCN(CC2)C(=O)OC(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)N2CCN(CC2)C(=O)OC(C)(C)C)S(=O)(=O)C

InChI

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