5-(tert-butylsulfonylamino)-N-(isoquinolin-1-ylmethyl)pentanamide

Systemtic Name: 5-(tert-butylsulfonylamino)-N-(isoquinolin-1-ylmethyl)pentanamide Openeye Name: 5-(tert-butylsulfonylamino)-N-(1-isoquinolylmethyl)pentanamide CAS Name: 5-(tert-butylsulfonylamino)-N-(1-isoquinolinylmethyl)pentanamide IUPAC Name: 5-(tert-butylsulfonylamino)-N-(isoquinolin-1-ylmethyl)pentanamide Traditional Name: 5-(tert-butylsulfonylamino)-N-(1-isoquinolylmethyl)valeramide Formula: C19H27N3O3S MolecularWeight: 377.50098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)NCCCCC(=O)NCC1=NC=CC2=CC=CC=C21

Isomeric SMILES

CC(C)(C)S(=O)(=O)NCCCCC(=O)NCC1=NC=CC2=CC=CC=C21

InChI

InChI=1S/C19H27N3O3S/c1-19(2,3)26(24,25)22-12-7-6-10-18(23)21-14-17-16-9-5-4-8-15(16)11-13-20-17/h4-5,8-9,11,13,22H,6-7,10,12,14H2,1-3H3,(H,21,23)