N-[2-[1H-imidazol-5-ylmethyl(phenyl)amino]ethyl]-N-(phenylmethyl)naphthalene-2-sulfonamide

Systemtic Name: N-[2-[1H-imidazol-5-ylmethyl(phenyl)amino]ethyl]-N-(phenylmethyl)naphthalene-2-sulfonamide Openeye Name: N-benzyl-N-[2-[N-(1H-imidazol-5-ylmethyl)anilino]ethyl]naphthalene-2-sulfonamide CAS Name: N-[2-[N-(1H-imidazol-5-ylmethyl)anilino]ethyl]-N-(phenylmethyl)-2-naphthalenesulfonamide IUPAC Name: N-benzyl-N-[2-[N-(1H-imidazol-5-ylmethyl)anilino]ethyl]naphthalene-2-sulfonamide Traditional Name: N-benzyl-N-[2-[N-(1H-imidazol-5-ylmethyl)anilino]ethyl]naphthalene-2-sulfonamide Formula: C29H28N4O2S MolecularWeight: 496.62322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCN(CC2=CN=CN2)C3=CC=CC=C3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)CN(CCN(CC2=CN=CN2)C3=CC=CC=C3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C29H28N4O2S/c34-36(35,29-16-15-25-11-7-8-12-26(25)19-29)33(21-24-9-3-1-4-10-24)18-17-32(22-27-20-30-23-31-27)28-13-5-2-6-14-28/h1-16,19-20,23H,17-18,21-22H2,(H,30,31)