N-[4-[bis(pyridin-2-ylmethyl)amino]butyl]-5-(dimethylamino)naphthalene-1-sulfonamide

Systemtic Name: N-[4-[bis(pyridin-2-ylmethyl)amino]butyl]-5-(dimethylamino)naphthalene-1-sulfonamide Openeye Name: N-[4-[bis(2-pyridylmethyl)amino]butyl]-5-(dimethylamino)naphthalene-1-sulfonamide CAS Name: N-[4-[bis(2-pyridinylmethyl)amino]butyl]-5-(dimethylamino)-1-naphthalenesulfonamide IUPAC Name: N-[4-[bis(pyridin-2-ylmethyl)amino]butyl]-5-(dimethylamino)naphthalene-1-sulfonamide Traditional Name: N-[4-[bis(2-pyridylmethyl)amino]butyl]-5-(dimethylamino)naphthalene-1-sulfonamide Formula: C28H33N5O2S MolecularWeight: 503.65892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H33N5O2S/c1-32(2)27-15-9-14-26-25(27)13-10-16-28(26)36(34,35)31-19-7-8-20-33(21-23-11-3-5-17-29-23)22-24-12-4-6-18-30-24/h3-6,9-18,31H,7-8,19-22H2,1-2H3