5-(2,5-dimethylpiperazin-1-yl)sulfonyl-2H-isoquinolin-1-one

Systemtic Name: 5-(2,5-dimethylpiperazin-1-yl)sulfonyl-2H-isoquinolin-1-one Openeye Name: 5-(2,5-dimethylpiperazin-1-yl)sulfonyl-2H-isoquinolin-1-one CAS Name: 5-[(2,5-dimethyl-1-piperazinyl)sulfonyl]-2H-isoquinolin-1-one IUPAC Name: 5-(2,5-dimethylpiperazin-1-yl)sulfonyl-2H-isoquinolin-1-one Traditional Name: 5-(2,5-dimethylpiperazino)sulfonylisocarbostyril Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNC(CN1S(=O)(=O)C2=CC=CC3=C2C=CNC3=O)C

Isomeric SMILES

CC1CNC(CN1S(=O)(=O)C2=CC=CC3=C2C=CNC3=O)C

InChI

InChI=1S/C15H19N3O3S/c1-10-9-18(11(2)8-17-10)22(20,21)14-5-3-4-13-12(14)6-7-16-15(13)19/h3-7,10-11,17H,8-9H2,1-2H3,(H,16,19)