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

Systemtic Name: (3R)-2-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-[[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CC5=CC=CC=C5CC4C(=O)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CC5=CC=CC=C5C[C@@H]4C(=O)N

InChI

InChI=1S/C26H25N3O4S/c27-25(30)24-15-19-7-2-4-9-22(19)17-29(24)26(31)20-10-5-11-23(14-20)34(32,33)28-13-12-18-6-1-3-8-21(18)16-28/h1-11,14,24H,12-13,15-17H2,(H2,27,30)/t24-/m1/s1