N-[3-[[6-(3-cyanophenyl)isoquinolin-8-yl]amino]propyl]methanesulfonamide

Systemtic Name: N-[3-[[6-(3-cyanophenyl)isoquinolin-8-yl]amino]propyl]methanesulfonamide Openeye Name: N-[3-[[6-(3-cyanophenyl)-8-isoquinolyl]amino]propyl]methanesulfonamide CAS Name: N-[3-[[6-(3-cyanophenyl)-8-isoquinolinyl]amino]propyl]methanesulfonamide IUPAC Name: N-[3-[[6-(3-cyanophenyl)isoquinolin-8-yl]amino]propyl]methanesulfonamide Traditional Name: N-[3-[[6-(3-cyanophenyl)-8-isoquinolyl]amino]propyl]methanesulfonamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCCNC1=C2C=NC=CC2=CC(=C1)C3=CC=CC(=C3)C#N

Isomeric SMILES

CS(=O)(=O)NCCCNC1=C2C=NC=CC2=CC(=C1)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H20N4O2S/c1-27(25,26)24-8-3-7-23-20-12-18(11-17-6-9-22-14-19(17)20)16-5-2-4-15(10-16)13-21/h2,4-6,9-12,14,23-24H,3,7-8H2,1H3