5-[(4-bromophenyl)sulfonylmethyl]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]furan-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]furan-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]furan-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]furan-2-carboxamide Traditional Name: 5-(brosylmethyl)-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-furamide Formula: C24H25BrN2O4S MolecularWeight: 517.4353

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCNC(=O)C3=CC=C(O3)CS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCNC(=O)C3=CC=C(O3)CS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H25BrN2O4S/c25-20-6-9-22(10-7-20)32(29,30)17-21-8-11-23(31-21)24(28)26-13-3-14-27-15-12-18-4-1-2-5-19(18)16-27/h1-2,4-11H,3,12-17H2,(H,26,28)