N-[3-[bis(pyridin-2-ylmethyl)amino]propyl]-5-(dimethylamino)naphthalene-1-sulfonamide

Systemtic Name: N-[3-[bis(pyridin-2-ylmethyl)amino]propyl]-5-(dimethylamino)naphthalene-1-sulfonamide Openeye Name: N-[3-[bis(2-pyridylmethyl)amino]propyl]-5-(dimethylamino)naphthalene-1-sulfonamide CAS Name: N-[3-[bis(2-pyridinylmethyl)amino]propyl]-5-(dimethylamino)-1-naphthalenesulfonamide IUPAC Name: N-[3-[bis(pyridin-2-ylmethyl)amino]propyl]-5-(dimethylamino)naphthalene-1-sulfonamide Traditional Name: N-[3-[bis(2-pyridylmethyl)amino]propyl]-5-(dimethylamino)naphthalene-1-sulfonamide Formula: C27H31N5O2S MolecularWeight: 489.63234

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCCCN(CC3=CC=CC=N3)CC4=CC=CC=N4

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCCCN(CC3=CC=CC=N3)CC4=CC=CC=N4

InChI

InChI=1S/C27H31N5O2S/c1-31(2)26-14-7-13-25-24(26)12-8-15-27(25)35(33,34)30-18-9-19-32(20-22-10-3-5-16-28-22)21-23-11-4-6-17-29-23/h3-8,10-17,30H,9,18-21H2,1-2H3