4-azanyl-3-[(4-bromanylphenoxy)methyl]-N-(2-oxidanylpropyl)thieno[3,2-c]pyridine-7-carboxamide

Systemtic Name: 4-azanyl-3-[(4-bromanylphenoxy)methyl]-N-(2-oxidanylpropyl)thieno[3,2-c]pyridine-7-carboxamide Openeye Name: 4-amino-3-[(4-bromophenoxy)methyl]-N-(2-hydroxypropyl)thieno[3,2-c]pyridine-7-carboxamide CAS Name: 4-amino-3-[(4-bromophenoxy)methyl]-N-(2-hydroxypropyl)-7-thieno[3,2-c]pyridinecarboxamide IUPAC Name: 4-amino-3-[(4-bromophenoxy)methyl]-N-(2-hydroxypropyl)thieno[3,2-c]pyridine-7-carboxamide Traditional Name: 4-amino-3-[(4-bromophenoxy)methyl]-N-(2-hydroxypropyl)thieno[3,2-c]pyridine-7-carboxamide Formula: C18H18BrN3O3S MolecularWeight: 436.32282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CN=C(C2=C1SC=C2COC3=CC=C(C=C3)Br)N)O

Isomeric SMILES

CC(CNC(=O)C1=CN=C(C2=C1SC=C2COC3=CC=C(C=C3)Br)N)O

InChI

InChI=1S/C18H18BrN3O3S/c1-10(23)6-22-18(24)14-7-21-17(20)15-11(9-26-16(14)15)8-25-13-4-2-12(19)3-5-13/h2-5,7,9-10,23H,6,8H2,1H3,(H2,20,21)(H,22,24)