tert-butyl N-(3-azanylpropyl)-N-[3-[(4-methylphenyl)sulfonylamino]propyl]carbamate

Systemtic Name: tert-butyl N-(3-azanylpropyl)-N-[3-[(4-methylphenyl)sulfonylamino]propyl]carbamate Openeye Name: tert-butyl N-(3-aminopropyl)-N-[3-(p-tolylsulfonylamino)propyl]carbamate CAS Name: N-(3-aminopropyl)-N-[3-[(4-methylphenyl)sulfonylamino]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-aminopropyl)-N-[3-[(4-methylphenyl)sulfonylamino]propyl]carbamate Traditional Name: N-(3-aminopropyl)-N-[3-(tosylamino)propyl]carbamic acid tert-butyl ester Formula: C18H31N3O4S MolecularWeight: 385.52144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCN(CCCN)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCN(CCCN)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H31N3O4S/c1-15-7-9-16(10-8-15)26(23,24)20-12-6-14-21(13-5-11-19)17(22)25-18(2,3)4/h7-10,20H,5-6,11-14,19H2,1-4H3