2-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(4-bromo-2-chloro-phenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(4-bromo-2-chlorophenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(4-bromo-2-chlorophenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(4-bromo-2-chloro-phenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C17H16BrClN2O3S MolecularWeight: 443.74254

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C17H16BrClN2O3S/c1-20-17(22)15-8-11-4-2-3-5-12(11)10-21(15)25(23,24)16-7-6-13(18)9-14(16)19/h2-7,9,15H,8,10H2,1H3,(H,20,22)