N-[2-[(2-chlorophenyl)methylamino]ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[2-[(2-chlorophenyl)methylamino]ethyl]isoquinoline-5-sulfonamide Openeye Name: N-[2-[(2-chlorophenyl)methylamino]ethyl]isoquinoline-5-sulfonamide CAS Name: N-[2-[(2-chlorophenyl)methylamino]ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-[2-[(2-chlorophenyl)methylamino]ethyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-[(2-chlorobenzyl)amino]ethyl]isoquinoline-5-sulfonamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNCCNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNCCNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)Cl

InChI

InChI=1S/C18H18ClN3O2S/c19-17-6-2-1-4-15(17)13-21-10-11-22-25(23,24)18-7-3-5-14-12-20-9-8-16(14)18/h1-9,12,21-22H,10-11,13H2