1-[4-(3-azanyl-1,2-benzoxazol-4-yl)phenyl]-3-(4-methylphenyl)urea

Systemtic Name: 1-[4-(3-azanyl-1,2-benzoxazol-4-yl)phenyl]-3-(4-methylphenyl)urea Openeye Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(p-tolyl)urea CAS Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(4-methylphenyl)urea IUPAC Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(4-methylphenyl)urea Traditional Name: 1-[4-(3-aminoindoxazen-4-yl)phenyl]-3-(p-tolyl)urea Formula: C21H18N4O2 MolecularWeight: 358.39322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C3=C4C(=CC=C3)ON=C4N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C3=C4C(=CC=C3)ON=C4N

InChI

InChI=1S/C21H18N4O2/c1-13-5-9-15(10-6-13)23-21(26)24-16-11-7-14(8-12-16)17-3-2-4-18-19(17)20(22)25-27-18/h2-12H,1H3,(H2,22,25)(H2,23,24,26)