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

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pyridin-2-yl-benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyridyl)benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyridinyl)benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pyridin-2-ylbenzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyridyl)benzamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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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=CC=CC=N4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC=CC=N4

InChI

InChI=1S/C21H19N3O3S/c25-21(23-20-10-3-4-12-22-20)17-8-5-9-19(14-17)28(26,27)24-13-11-16-6-1-2-7-18(16)15-24/h1-10,12,14H,11,13,15H2,(H,22,23,25)