tert-butyl N-[2-(isoquinolin-5-ylsulfonylamino)ethyl]carbamate

Systemtic Name: tert-butyl N-[2-(isoquinolin-5-ylsulfonylamino)ethyl]carbamate Openeye Name: tert-butyl N-[2-(5-isoquinolylsulfonylamino)ethyl]carbamate CAS Name: N-[2-(5-isoquinolinylsulfonylamino)ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(isoquinolin-5-ylsulfonylamino)ethyl]carbamate Traditional Name: N-[2-(5-isoquinolylsulfonylamino)ethyl]carbamic acid tert-butyl ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C16H21N3O4S/c1-16(2,3)23-15(20)18-9-10-19-24(21,22)14-6-4-5-12-11-17-8-7-13(12)14/h4-8,11,19H,9-10H2,1-3H3,(H,18,20)