4-bromanyl-5-chloranyl-N-[4-(3,4-dihydroisoquinolin-1-yl)-2-methoxy-phenyl]thiophene-2-sulfonamide

Systemtic Name: 4-bromanyl-5-chloranyl-N-[4-(3,4-dihydroisoquinolin-1-yl)-2-methoxy-phenyl]thiophene-2-sulfonamide Openeye Name: 4-bromo-5-chloro-N-[4-(3,4-dihydroisoquinolin-1-yl)-2-methoxy-phenyl]thiophene-2-sulfonamide CAS Name: 4-bromo-5-chloro-N-[4-(3,4-dihydroisoquinolin-1-yl)-2-methoxyphenyl]-2-thiophenesulfonamide IUPAC Name: 4-bromo-5-chloro-N-[4-(3,4-dihydroisoquinolin-1-yl)-2-methoxyphenyl]thiophene-2-sulfonamide Traditional Name: 4-bromo-5-chloro-N-[4-(3,4-dihydroisoquinolin-1-yl)-2-methoxy-phenyl]thiophene-2-sulfonamide Formula: C20H16BrClN2O3S2 MolecularWeight: 511.83964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NCCC3=CC=CC=C32)NS(=O)(=O)C4=CC(=C(S4)Cl)Br

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NCCC3=CC=CC=C32)NS(=O)(=O)C4=CC(=C(S4)Cl)Br

InChI

InChI=1S/C20H16BrClN2O3S2/c1-27-17-10-13(19-14-5-3-2-4-12(14)8-9-23-19)6-7-16(17)24-29(25,26)18-11-15(21)20(22)28-18/h2-7,10-11,24H,8-9H2,1H3