N-isoquinolin-5-yl-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-isoquinolin-5-yl-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(5-isoquinolyl)-1-tetralin-6-ylsulfonyl-piperidine-4-carboxamide CAS Name: N-(5-isoquinolinyl)-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-isoquinolin-5-yl-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(5-isoquinolyl)-1-tetralin-6-ylsulfonyl-isonipecotamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C25H27N3O3S/c29-25(27-24-7-3-6-21-17-26-13-10-23(21)24)19-11-14-28(15-12-19)32(30,31)22-9-8-18-4-1-2-5-20(18)16-22/h3,6-10,13,16-17,19H,1-2,4-5,11-12,14-15H2,(H,27,29)