tert-butyl N-[4-(isoquinolin-5-ylsulfonylamino)-2-phenyl-butyl]carbamate

Systemtic Name: tert-butyl N-[4-(isoquinolin-5-ylsulfonylamino)-2-phenyl-butyl]carbamate Openeye Name: tert-butyl N-[4-(5-isoquinolylsulfonylamino)-2-phenyl-butyl]carbamate CAS Name: N-[4-(5-isoquinolinylsulfonylamino)-2-phenylbutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(isoquinolin-5-ylsulfonylamino)-2-phenylbutyl]carbamate Traditional Name: N-[4-(5-isoquinolylsulfonylamino)-2-phenyl-butyl]carbamic acid tert-butyl ester Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(CCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCC(CCNS(=O)(=O)C1=CC=CC2=C1C=CN=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O4S/c1-24(2,3)31-23(28)26-17-19(18-8-5-4-6-9-18)12-15-27-32(29,30)22-11-7-10-20-16-25-14-13-21(20)22/h4-11,13-14,16,19,27H,12,15,17H2,1-3H3,(H,26,28)