(1-phenyl-1,2,3,4-tetrazol-5-yl) (1Z)-N-[(4-bromophenyl)amino]-2-oxidanylidene-2-phenyl-ethanimidothioate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl) (1Z)-N-[(4-bromophenyl)amino]-2-oxidanylidene-2-phenyl-ethanimidothioate Openeye Name: (1-phenyltetrazol-5-yl) (1Z)-N-(4-bromoanilino)-2-oxo-2-phenyl-ethanimidothioate CAS Name: (1Z)-N-(4-bromoanilino)-2-oxo-2-phenylethanimidothioic acid (1-phenyl-5-tetrazolyl) ester IUPAC Name: (1-phenyltetrazol-5-yl) (1Z)-N-(4-bromoanilino)-2-oxo-2-phenylethanimidothioate Traditional Name: (1Z)-N-(4-bromoanilino)-2-keto-2-phenyl-thioacetimidic acid (1-phenyltetrazol-5-yl) ester Formula: C21H15BrN6OS MolecularWeight: 479.3524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(=NNC2=CC=C(C=C2)Br)SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C(=N/NC2=CC=C(C=C2)Br)/SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H15BrN6OS/c22-16-11-13-17(14-12-16)23-24-20(19(29)15-7-3-1-4-8-15)30-21-25-26-27-28(21)18-9-5-2-6-10-18/h1-14,23H/b24-20-