N-(4-bromophenyl)-3-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide

Systemtic Name: N-(4-bromophenyl)-3-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide Openeye Name: N-(4-bromophenyl)-3-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide CAS Name: N-(4-bromophenyl)-3-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]propanamide IUPAC Name: N-(4-bromophenyl)-3-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide Traditional Name: N-(4-bromophenyl)-3-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]propionamide Formula: C17H13BrN4O4S MolecularWeight: 449.27852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN=C(O2)SCCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN=C(O2)SCCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H13BrN4O4S/c18-12-4-6-13(7-5-12)19-15(23)8-9-27-17-21-20-16(26-17)11-2-1-3-14(10-11)22(24)25/h1-7,10H,8-9H2,(H,19,23)