benzotriazol-1-ylmethyl (E)-N-[[2,4-bis(bromanyl)phenyl]amino]benzenecarboximidothioate

Systemtic Name: benzotriazol-1-ylmethyl (E)-N-[[2,4-bis(bromanyl)phenyl]amino]benzenecarboximidothioate Openeye Name: benzotriazol-1-ylmethyl (E)-N-(2,4-dibromoanilino)benzenecarboximidothioate CAS Name: (E)-N-(2,4-dibromoanilino)benzenecarboximidothioic acid 1-benzotriazolylmethyl ester IUPAC Name: benzotriazol-1-ylmethyl (E)-N-(2,4-dibromoanilino)benzenecarboximidothioate Traditional Name: (E)-N-(2,4-dibromoanilino)benzenecarboximidothioic acid benzotriazol-1-ylmethyl ester Formula: C20H15Br2N5S MolecularWeight: 517.2396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NNC2=C(C=C(C=C2)Br)Br)SCN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)/C(=N\NC2=C(C=C(C=C2)Br)Br)/SCN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H15Br2N5S/c21-15-10-11-17(16(22)12-15)23-25-20(14-6-2-1-3-7-14)28-13-27-19-9-5-4-8-18(19)24-26-27/h1-12,23H,13H2/b25-20+