tert-butyl N-(2-cyanoethyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]carbamate

Systemtic Name: tert-butyl N-(2-cyanoethyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]carbamate Openeye Name: tert-butyl N-(2-cyanoethyl)-N-[2-(p-tolylsulfonylamino)ethyl]carbamate CAS Name: N-(2-cyanoethyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(2-cyanoethyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]carbamate Traditional Name: N-(2-cyanoethyl)-N-[2-(tosylamino)ethyl]carbamic acid tert-butyl ester Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCN(CCC#N)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCN(CCC#N)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H25N3O4S/c1-14-6-8-15(9-7-14)25(22,23)19-11-13-20(12-5-10-18)16(21)24-17(2,3)4/h6-9,19H,5,11-13H2,1-4H3