3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[phenyl(pyridin-2-yl)methyl]benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[phenyl(pyridin-2-yl)methyl]benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[phenyl(2-pyridyl)methyl]benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[phenyl(2-pyridinyl)methyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[phenyl(pyridin-2-yl)methyl]benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[phenyl(2-pyridyl)methyl]benzamide Formula: C28H25N3O3S MolecularWeight: 483.5814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=N5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=N5

InChI

InChI=1S/C28H25N3O3S/c32-28(30-27(22-10-2-1-3-11-22)26-15-6-7-17-29-26)23-13-8-14-25(19-23)35(33,34)31-18-16-21-9-4-5-12-24(21)20-31/h1-15,17,19,27H,16,18,20H2,(H,30,32)