5-(4-azanylpiperidin-1-yl)sulfonyl-2H-isoquinolin-1-one

Systemtic Name: 5-(4-azanylpiperidin-1-yl)sulfonyl-2H-isoquinolin-1-one Openeye Name: 5-[(4-amino-1-piperidyl)sulfonyl]-2H-isoquinolin-1-one CAS Name: 5-[(4-amino-1-piperidinyl)sulfonyl]-2H-isoquinolin-1-one IUPAC Name: 5-(4-aminopiperidin-1-yl)sulfonyl-2H-isoquinolin-1-one Traditional Name: 5-(4-aminopiperidino)sulfonylisocarbostyril Formula: C14H17N3O3S MolecularWeight: 307.36808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N)S(=O)(=O)C2=CC=CC3=C2C=CNC3=O

Isomeric SMILES

C1CN(CCC1N)S(=O)(=O)C2=CC=CC3=C2C=CNC3=O

InChI

InChI=1S/C14H17N3O3S/c15-10-5-8-17(9-6-10)21(19,20)13-3-1-2-12-11(13)4-7-16-14(12)18/h1-4,7,10H,5-6,8-9,15H2,(H,16,18)