1-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]thiourea

Systemtic Name: 1-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]thiourea Openeye Name: [2-(2-bromophenyl)-1,3-benzoxazol-5-yl]thiourea CAS Name: [2-(2-bromophenyl)-1,3-benzoxazol-5-yl]thiourea IUPAC Name: [2-(2-bromophenyl)-1,3-benzoxazol-5-yl]thiourea Traditional Name: [2-(2-bromophenyl)-1,3-benzoxazol-5-yl]thiourea Formula: C14H10BrN3OS MolecularWeight: 348.2177

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)N)Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)N)Br

InChI

InChI=1S/C14H10BrN3OS/c15-10-4-2-1-3-9(10)13-18-11-7-8(17-14(16)20)5-6-12(11)19-13/h1-7H,(H3,16,17,20)