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

Systemtic Name: 3-[[(3-nitrophenyl)amino]methyl]-1,3-benzoxazole-2-thione Openeye Name: 3-[(3-nitroanilino)methyl]-1,3-benzoxazole-2-thione CAS Name: 3-[(3-nitroanilino)methyl]-1,3-benzoxazole-2-thione IUPAC Name: 3-[(3-nitroanilino)methyl]-1,3-benzoxazole-2-thione Traditional Name: 3-[(3-nitroanilino)methyl]-1,3-benzoxazole-2-thione Formula: C14H11N3O3S MolecularWeight: 301.32044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=S)O2)CNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=S)O2)CNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O3S/c18-17(19)11-5-3-4-10(8-11)15-9-16-12-6-1-2-7-13(12)20-14(16)21/h1-8,15H,9H2