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

Systemtic Name: 1-[4-(3-azanyl-1,2-benzoxazol-4-yl)phenyl]-3-(3-cyanophenyl)urea Openeye Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(3-cyanophenyl)urea CAS Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(3-cyanophenyl)urea IUPAC Name: 1-[4-(3-amino-1,2-benzoxazol-4-yl)phenyl]-3-(3-cyanophenyl)urea Traditional Name: 1-[4-(3-aminoindoxazen-4-yl)phenyl]-3-(3-cyanophenyl)urea Formula: C21H15N5O2 MolecularWeight: 369.3761

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15N5O2/c22-12-13-3-1-4-16(11-13)25-21(27)24-15-9-7-14(8-10-15)17-5-2-6-18-19(17)20(23)26-28-18/h1-11H,(H2,23,26)(H2,24,25,27)