N-[(S)-cyclopropyl(phenyl)methyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanesulfonamide

Systemtic Name: N-[(S)-cyclopropyl(phenyl)methyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanesulfonamide Openeye Name: N-[(S)-cyclopropyl(phenyl)methyl]-2-(1-oxo-2-isoquinolyl)ethanesulfonamide CAS Name: N-[(S)-cyclopropyl(phenyl)methyl]-2-(1-oxo-2-isoquinolinyl)ethanesulfonamide IUPAC Name: N-[(S)-cyclopropyl(phenyl)methyl]-2-(1-oxoisoquinolin-2-yl)ethanesulfonamide Traditional Name: N-[(S)-cyclopropyl(phenyl)methyl]-2-(1-keto-2-isoquinolyl)ethanesulfonamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=CC=C2)NS(=O)(=O)CCN3C=CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CC1[C@@H](C2=CC=CC=C2)NS(=O)(=O)CCN3C=CC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H22N2O3S/c24-21-19-9-5-4-6-16(19)12-13-23(21)14-15-27(25,26)22-20(18-10-11-18)17-7-2-1-3-8-17/h1-9,12-13,18,20,22H,10-11,14-15H2/t20-/m1/s1