4-[2-[(1-chloranylisoquinolin-3-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[(1-chloranylisoquinolin-3-yl)amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[(1-chloro-3-isoquinolyl)amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[(1-chloro-3-isoquinolinyl)amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[(1-chloroisoquinolin-3-yl)amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[(1-chloro-3-isoquinolyl)amino]ethyl]benzenesulfonamide Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N=C2Cl)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N=C2Cl)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C17H16ClN3O2S/c18-17-15-4-2-1-3-13(15)11-16(21-17)20-10-9-12-5-7-14(8-6-12)24(19,22)23/h1-8,11H,9-10H2,(H,20,21)(H2,19,22,23)