1,3-bis(benzotriazol-1-ylmethyl)urea

Systemtic Name: 1,3-bis(benzotriazol-1-ylmethyl)urea Openeye Name: 1,3-bis(benzotriazol-1-ylmethyl)urea CAS Name: 1,3-bis(1-benzotriazolylmethyl)urea IUPAC Name: 1,3-bis(benzotriazol-1-ylmethyl)urea Traditional Name: 1,3-bis(benzotriazol-1-ylmethyl)urea Formula: C15H14N8O MolecularWeight: 322.32466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CNC(=O)NCN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CNC(=O)NCN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C15H14N8O/c24-15(16-9-22-13-7-3-1-5-11(13)18-20-22)17-10-23-14-8-4-2-6-12(14)19-21-23/h1-8H,9-10H2,(H2,16,17,24)