N-(4-bromanyl-3-methyl-phenyl)-2-[[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[[5-(2-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]acetamide Formula: C17H13BrN4O4S MolecularWeight: 449.27852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-])Br

InChI

InChI=1S/C17H13BrN4O4S/c1-10-8-11(6-7-13(10)18)19-15(23)9-27-17-21-20-16(26-17)12-4-2-3-5-14(12)22(24)25/h2-8H,9H2,1H3,(H,19,23)