N-[N'-[(2-chloranyl-6-phenoxy-phenyl)methyl]carbamimidoyl]-4-phenylazanyl-piperidine-1-carboxamide

Systemtic Name: N-[N'-[(2-chloranyl-6-phenoxy-phenyl)methyl]carbamimidoyl]-4-phenylazanyl-piperidine-1-carboxamide Openeye Name: 4-anilino-N-[N'-[(2-chloro-6-phenoxy-phenyl)methyl]carbamimidoyl]piperidine-1-carboxamide CAS Name: N-[amino-[(2-chloro-6-phenoxyphenyl)methylimino]methyl]-4-anilino-1-piperidinecarboxamide IUPAC Name: 4-anilino-N-[N'-[(2-chloro-6-phenoxyphenyl)methyl]carbamimidoyl]piperidine-1-carboxamide Traditional Name: 4-anilino-N-[N'-(2-chloro-6-phenoxy-benzyl)amidino]piperidine-1-carboxamide Formula: C26H28ClN5O2 MolecularWeight: 477.98582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC=CC=C2)C(=O)NC(=NCC3=C(C=CC=C3Cl)OC4=CC=CC=C4)N

Isomeric SMILES

C1CN(CCC1NC2=CC=CC=C2)C(=O)NC(=NCC3=C(C=CC=C3Cl)OC4=CC=CC=C4)N

InChI

InChI=1S/C26H28ClN5O2/c27-23-12-7-13-24(34-21-10-5-2-6-11-21)22(23)18-29-25(28)31-26(33)32-16-14-20(15-17-32)30-19-8-3-1-4-9-19/h1-13,20,30H,14-18H2,(H3,28,29,31,33)