(1E)-1-[benzotriazol-1-yl-[(4-methylphenyl)amino]methylidene]-3-phenyl-urea

Systemtic Name: (1E)-1-[benzotriazol-1-yl-[(4-methylphenyl)amino]methylidene]-3-phenyl-urea Openeye Name: (1E)-1-[benzotriazol-1-yl-(4-methylanilino)methylene]-3-phenyl-urea CAS Name: (1E)-1-[1-benzotriazolyl-(4-methylanilino)methylidene]-3-phenylurea IUPAC Name: (1E)-1-[benzotriazol-1-yl-(4-methylanilino)methylidene]-3-phenylurea Traditional Name: (1E)-1-[benzotriazol-1-yl(p-toluidino)methylene]-3-phenyl-urea Formula: C21H18N6O MolecularWeight: 370.40722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=NC(=O)NC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC=C(C=C1)N/C(=N\C(=O)NC2=CC=CC=C2)/N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H18N6O/c1-15-11-13-17(14-12-15)22-20(24-21(28)23-16-7-3-2-4-8-16)27-19-10-6-5-9-18(19)25-26-27/h2-14H,1H3,(H2,22,23,24,28)