1-[2-(4-cyanophenyl)-5-phenyl-1,2,3-triazol-4-yl]urea

Systemtic Name: 1-[2-(4-cyanophenyl)-5-phenyl-1,2,3-triazol-4-yl]urea Openeye Name: [2-(4-cyanophenyl)-5-phenyl-triazol-4-yl]urea CAS Name: [2-(4-cyanophenyl)-5-phenyl-4-triazolyl]urea IUPAC Name: [2-(4-cyanophenyl)-5-phenyltriazol-4-yl]urea Traditional Name: [2-(4-cyanophenyl)-5-phenyl-triazol-4-yl]urea Formula: C16H12N6O MolecularWeight: 304.30608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=C2NC(=O)N)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=C2NC(=O)N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H12N6O/c17-10-11-6-8-13(9-7-11)22-20-14(12-4-2-1-3-5-12)15(21-22)19-16(18)23/h1-9H,(H3,18,19,21,23)