ethyl 4-[2-[(4-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[4-chloro-2-methyl-N-(p-tolylsulfonyl)anilino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(4-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-chloro-2-methyl-N-tosyl-anilino)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H28ClN3O5S MolecularWeight: 494.00352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=C(C=C(C=C2)Cl)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=C(C=C(C=C2)Cl)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H28ClN3O5S/c1-4-32-23(29)26-13-11-25(12-14-26)22(28)16-27(21-10-7-19(24)15-18(21)3)33(30,31)20-8-5-17(2)6-9-20/h5-10,15H,4,11-14,16H2,1-3H3