3-azanyl-N-[[4-(phenylcarbamoylamino)phenyl]methyl]-1,2-benzoxazole-4-carboxamide

Systemtic Name: 3-azanyl-N-[[4-(phenylcarbamoylamino)phenyl]methyl]-1,2-benzoxazole-4-carboxamide Openeye Name: 3-amino-N-[[4-(phenylcarbamoylamino)phenyl]methyl]-1,2-benzoxazole-4-carboxamide CAS Name: 3-amino-N-[[4-[[anilino(oxo)methyl]amino]phenyl]methyl]-1,2-benzoxazole-4-carboxamide IUPAC Name: 3-amino-N-[[4-(phenylcarbamoylamino)phenyl]methyl]-1,2-benzoxazole-4-carboxamide Traditional Name: 3-amino-N-[4-(phenylcarbamoylamino)benzyl]indoxazene-4-carboxamide Formula: C22H19N5O3 MolecularWeight: 401.41796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CNC(=O)C3=C4C(=CC=C3)ON=C4N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CNC(=O)C3=C4C(=CC=C3)ON=C4N

InChI

InChI=1S/C22H19N5O3/c23-20-19-17(7-4-8-18(19)30-27-20)21(28)24-13-14-9-11-16(12-10-14)26-22(29)25-15-5-2-1-3-6-15/h1-12H,13H2,(H2,23,27)(H,24,28)(H2,25,26,29)