3-cyano-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide

Systemtic Name: 3-cyano-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide Openeye Name: 3-cyano-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide CAS Name: 3-cyano-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide IUPAC Name: 3-cyano-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide Traditional Name: 3-cyano-N-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propyl]benzamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)CCCNC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)CCCNC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H21N3O3S/c21-14-16-5-3-8-18(13-16)20(24)22-10-4-12-27(25,26)23-11-9-17-6-1-2-7-19(17)15-23/h1-3,5-8,13H,4,9-12,15H2,(H,22,24)