N-(3-imidazol-1-ylpropyl)-4-pentoxy-naphthalene-1-sulfonamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-4-pentoxy-naphthalene-1-sulfonamide Openeye Name: N-(3-imidazol-1-ylpropyl)-4-pentoxy-naphthalene-1-sulfonamide CAS Name: N-[3-(1-imidazolyl)propyl]-4-pentoxy-1-naphthalenesulfonamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-4-pentoxynaphthalene-1-sulfonamide Traditional Name: 4-amoxy-N-(3-imidazol-1-ylpropyl)naphthalene-1-sulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C2=CC=CC=C21)S(=O)(=O)NCCCN3C=CN=C3

Isomeric SMILES

CCCCCOC1=CC=C(C2=CC=CC=C21)S(=O)(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C21H27N3O3S/c1-2-3-6-16-27-20-10-11-21(19-9-5-4-8-18(19)20)28(25,26)23-12-7-14-24-15-13-22-17-24/h4-5,8-11,13,15,17,23H,2-3,6-7,12,14,16H2,1H3