methyl 7-bromanyl-1-[4-(methylsulfamoyl)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name: methyl 7-bromanyl-1-[4-(methylsulfamoyl)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: methyl 7-bromo-1-[4-(methylsulfamoyl)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 7-bromo-1-[4-(methylsulfamoyl)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester IUPAC Name: methyl 7-bromo-1-[4-(methylsulfamoyl)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-bromo-1-[4-(methylsulfamoyl)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester Formula: C19H19BrN2O4S MolecularWeight: 451.33416

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)N2CCC(=CC3=C2C=CC(=C3)Br)C(=O)OC

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)N2CCC(=CC3=C2C=CC(=C3)Br)C(=O)OC

InChI

InChI=1S/C19H19BrN2O4S/c1-21-27(24,25)17-6-4-16(5-7-17)22-10-9-13(19(23)26-2)11-14-12-15(20)3-8-18(14)22/h3-8,11-12,21H,9-10H2,1-2H3