tert-butyl N-[5-[4-[1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]pent-4-ynyl]carbamate

Systemtic Name: tert-butyl N-[5-[4-[1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]pent-4-ynyl]carbamate Openeye Name: tert-butyl N-[5-[4-[2-(isopropylsulfonylamino)-1-methyl-ethyl]phenyl]pent-4-ynyl]carbamate CAS Name: N-[5-[4-[1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]pent-4-ynyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[4-[1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]pent-4-ynyl]carbamate Traditional Name: N-[5-[4-[2-(isopropylsulfonylamino)-1-methyl-ethyl]phenyl]pent-4-ynyl]carbamic acid tert-butyl ester Formula: C22H34N2O4S MolecularWeight: 422.58136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCC(C)C1=CC=C(C=C1)C#CCCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)S(=O)(=O)NCC(C)C1=CC=C(C=C1)C#CCCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C22H34N2O4S/c1-17(2)29(26,27)24-16-18(3)20-13-11-19(12-14-20)10-8-7-9-15-23-21(25)28-22(4,5)6/h11-14,17-18,24H,7,9,15-16H2,1-6H3,(H,23,25)