tert-butyl 4-[(Z)-N-[(4-methylphenyl)sulfonylamino]-C-(phenylmethyl)carbonimidoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(Z)-N-[(4-methylphenyl)sulfonylamino]-C-(phenylmethyl)carbonimidoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(Z)-C-benzyl-N-(p-tolylsulfonylamino)carbonimidoyl]piperidine-1-carboxylate CAS Name: 4-[(1Z)-1-[(4-methylphenyl)sulfonylhydrazinylidene]-2-phenylethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(Z)-C-benzyl-N-[(4-methylphenyl)sulfonylamino]carbonimidoyl]piperidine-1-carboxylate Traditional Name: 4-[(Z)-C-benzyl-N-(tosylamino)carbonimidoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN=C(CC2=CC=CC=C2)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N/N=C(/CC2=CC=CC=C2)\C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H33N3O4S/c1-19-10-12-22(13-11-19)33(30,31)27-26-23(18-20-8-6-5-7-9-20)21-14-16-28(17-15-21)24(29)32-25(2,3)4/h5-13,21,27H,14-18H2,1-4H3/b26-23-