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

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pyridin-2-yl-benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyridyl)benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyridinyl)benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pyridin-2-ylbenzamide Traditional Name: 4-(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=C(C=C3)C(=O)NC4=CC=CC=N4

Isomeric SMILES

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

InChI

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