[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl] (1Z)-2-(4-bromophenyl)-2-oxidanylidene-N-phenylazanyl-ethanimidothioate

Systemtic Name: [5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl] (1Z)-2-(4-bromophenyl)-2-oxidanylidene-N-phenylazanyl-ethanimidothioate Openeye Name: [5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl] (1Z)-N-anilino-2-(4-bromophenyl)-2-oxo-ethanimidothioate CAS Name: (1Z)-N-anilino-2-(4-bromophenyl)-2-oxoethanimidothioic acid [5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl] ester IUPAC Name: [5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl] (1Z)-N-anilino-2-(4-bromophenyl)-2-oxoethanimidothioate Traditional Name: (1Z)-N-anilino-2-(4-bromophenyl)-2-keto-thioacetimidic acid [5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl] ester Formula: C22H14BrN5O4S MolecularWeight: 524.34666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN=C(C(=O)C2=CC=C(C=C2)Br)SC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N/N=C(/C(=O)C2=CC=C(C=C2)Br)\SC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14BrN5O4S/c23-16-11-9-14(10-12-16)19(29)21(26-24-17-6-2-1-3-7-17)33-22-27-25-20(32-22)15-5-4-8-18(13-15)28(30)31/h1-13,24H/b26-21-