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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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