3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(5-morpholin-4-ylpyridin-2-yl)benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(5-morpholin-4-ylpyridin-2-yl)benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(5-morpholino-2-pyridyl)benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[5-(4-morpholinyl)-2-pyridinyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(5-morpholin-4-ylpyridin-2-yl)benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(5-morpholino-2-pyridyl)benzamide Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=NC=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=NC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C25H26N4O4S/c30-25(27-24-9-8-22(17-26-24)28-12-14-33-15-13-28)20-6-3-7-23(16-20)34(31,32)29-11-10-19-4-1-2-5-21(19)18-29/h1-9,16-17H,10-15,18H2,(H,26,27,30)