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

Systemtic Name: 2-chloranyl-N-(2-chloranylpyridin-4-yl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: 2-chloro-N-(2-chloro-4-pyridyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: 2-chloro-N-(2-chloro-4-pyridinyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2-chloropyridin-4-yl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: 2-chloro-N-(2-chloro-4-pyridyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C21H17Cl2N3O3S MolecularWeight: 462.34898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17Cl2N3O3S/c22-19-6-5-17(12-18(19)21(27)25-16-7-9-24-20(23)11-16)30(28,29)26-10-8-14-3-1-2-4-15(14)13-26/h1-7,9,11-12H,8,10,13H2,(H,24,25,27)