1,3-bis(2H-benzotriazol-4-ylmethyl)urea

Systemtic Name: 1,3-bis(2H-benzotriazol-4-ylmethyl)urea Openeye Name: 1,3-bis(2H-benzotriazol-4-ylmethyl)urea CAS Name: 1,3-bis(2H-benzotriazol-4-ylmethyl)urea IUPAC Name: 1,3-bis(2H-benzotriazol-4-ylmethyl)urea Traditional Name: 1,3-bis(2H-benzotriazol-4-ylmethyl)urea Formula: C15H14N8O MolecularWeight: 322.32466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NNN=C2C(=C1)CNC(=O)NCC3=CC=CC4=NNN=C43

Isomeric SMILES

C1=CC2=NNN=C2C(=C1)CNC(=O)NCC3=CC=CC4=NNN=C43

InChI

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