1-[C-(benzotriazol-1-yl)-N-(phenylmethyl)carbonimidoyl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[C-(benzotriazol-1-yl)-N-(phenylmethyl)carbonimidoyl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[C-(benzotriazol-1-yl)-N-benzyl-carbonimidoyl]-3-(4-methoxyphenyl)urea CAS Name: 1-[1-benzotriazolyl-(phenylmethyl)iminomethyl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[C-(benzotriazol-1-yl)-N-benzylcarbonimidoyl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[C-(benzotriazol-1-yl)-N-benzyl-carbonimidoyl]-3-(4-methoxyphenyl)urea Formula: C22H20N6O2 MolecularWeight: 400.4332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC(=NCC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC(=NCC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H20N6O2/c1-30-18-13-11-17(12-14-18)24-22(29)25-21(23-15-16-7-3-2-4-8-16)28-20-10-6-5-9-19(20)26-27-28/h2-14H,15H2,1H3,(H2,23,24,25,29)