4-azanyl-N-[2-[[5-bromanyl-2-(thiophen-2-ylmethoxy)phenyl]methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide

Systemtic Name: 4-azanyl-N-[2-[[5-bromanyl-2-(thiophen-2-ylmethoxy)phenyl]methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide Openeye Name: 4-amino-N-[2-[[5-bromo-2-(2-thienylmethoxy)phenyl]methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide CAS Name: 4-amino-N-[2-[[5-bromo-2-(thiophen-2-ylmethoxy)phenyl]methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide IUPAC Name: 4-amino-N-[2-[[5-bromo-2-(thiophen-2-ylmethoxy)phenyl]methylamino]ethyl]-1,2,5-oxadiazole-3-carboxamide Traditional Name: 4-amino-N-[2-[[5-bromo-2-(2-thenyloxy)benzyl]amino]ethyl]furazan-3-carboxamide Formula: C17H18BrN5O3S MolecularWeight: 452.32552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)COC2=C(C=C(C=C2)Br)CNCCNC(=O)C3=NON=C3N

Isomeric SMILES

C1=CSC(=C1)COC2=C(C=C(C=C2)Br)CNCCNC(=O)C3=NON=C3N

InChI

InChI=1S/C17H18BrN5O3S/c18-12-3-4-14(25-10-13-2-1-7-27-13)11(8-12)9-20-5-6-21-17(24)15-16(19)23-26-22-15/h1-4,7-8,20H,5-6,9-10H2,(H2,19,23)(H,21,24)