5-bromanyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)furan-2-carboxamide Openeye Name: 5-bromo-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)furan-2-carboxamide CAS Name: 5-bromo-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-furancarboxamide IUPAC Name: 5-bromo-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)furan-2-carboxamide Traditional Name: 5-bromo-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-furamide Formula: C17H19BrN2O4S MolecularWeight: 427.31276

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CCCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C17H19BrN2O4S/c1-2-9-25(22,23)20-8-7-12-3-4-14(10-13(12)11-20)19-17(21)15-5-6-16(18)24-15/h3-6,10H,2,7-9,11H2,1H3,(H,19,21)