1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonylpiperidine-2-carboxamide

Systemtic Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonylpiperidine-2-carboxamide Openeye Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]piperidine-2-carboxamide CAS Name: 1-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-oxomethyl]-2-piperidinecarboxamide IUPAC Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]piperidine-2-carboxamide Traditional Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]pipecolinamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(C(C1)C(=O)N)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H25N3O4S/c23-21(26)20-10-3-4-12-25(20)22(27)17-8-5-9-19(14-17)30(28,29)24-13-11-16-6-1-2-7-18(16)15-24/h1-2,5-9,14,20H,3-4,10-13,15H2,(H2,23,26)