3-[[(4-bromophenyl)amino]methyl]-1,3-benzoxazole-2-thione

Systemtic Name: 3-[[(4-bromophenyl)amino]methyl]-1,3-benzoxazole-2-thione Openeye Name: 3-[(4-bromoanilino)methyl]-1,3-benzoxazole-2-thione CAS Name: 3-[(4-bromoanilino)methyl]-1,3-benzoxazole-2-thione IUPAC Name: 3-[(4-bromoanilino)methyl]-1,3-benzoxazole-2-thione Traditional Name: 3-[(4-bromoanilino)methyl]-1,3-benzoxazole-2-thione Formula: C14H11BrN2OS MolecularWeight: 335.21894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=S)O2)CNC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=S)O2)CNC3=CC=C(C=C3)Br

InChI

InChI=1S/C14H11BrN2OS/c15-10-5-7-11(8-6-10)16-9-17-12-3-1-2-4-13(12)18-14(17)19/h1-8,16H,9H2