1-[4-(3-azanyl-7-fluoranyl-1,2-benzoxazol-4-yl)phenyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[4-(3-azanyl-7-fluoranyl-1,2-benzoxazol-4-yl)phenyl]-3-(3-methylphenyl)urea Openeye Name: 1-[4-(3-amino-7-fluoro-1,2-benzoxazol-4-yl)phenyl]-3-(m-tolyl)urea CAS Name: 1-[4-(3-amino-7-fluoro-1,2-benzoxazol-4-yl)phenyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[4-(3-amino-7-fluoro-1,2-benzoxazol-4-yl)phenyl]-3-(3-methylphenyl)urea Traditional Name: 1-[4-(3-amino-7-fluoro-indoxazen-4-yl)phenyl]-3-(m-tolyl)urea Formula: C21H17FN4O2 MolecularWeight: 376.383683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17FN4O2/c1-12-3-2-4-15(11-12)25-21(27)24-14-7-5-13(6-8-14)16-9-10-17(22)19-18(16)20(23)26-28-19/h2-11H,1H3,(H2,23,26)(H2,24,25,27)