N-(5-cyano-6-ethyl-2,1,3-benzoxadiazol-4-yl)-5-(dimethylamino)naphthalene-1-sulfonamide

Systemtic Name: N-(5-cyano-6-ethyl-2,1,3-benzoxadiazol-4-yl)-5-(dimethylamino)naphthalene-1-sulfonamide Openeye Name: N-(5-cyano-6-ethyl-2,1,3-benzoxadiazol-4-yl)-5-(dimethylamino)naphthalene-1-sulfonamide CAS Name: N-(5-cyano-6-ethyl-2,1,3-benzoxadiazol-4-yl)-5-(dimethylamino)-1-naphthalenesulfonamide IUPAC Name: N-(5-cyano-6-ethyl-2,1,3-benzoxadiazol-4-yl)-5-(dimethylamino)naphthalene-1-sulfonamide Traditional Name: N-(5-cyano-6-ethyl-benzofurazan-4-yl)-5-(dimethylamino)naphthalene-1-sulfonamide Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=NON=C2C(=C1C#N)NS(=O)(=O)C3=CC=CC4=C3C=CC=C4N(C)C

Isomeric SMILES

CCC1=CC2=NON=C2C(=C1C#N)NS(=O)(=O)C3=CC=CC4=C3C=CC=C4N(C)C

InChI

InChI=1S/C21H19N5O3S/c1-4-13-11-17-21(24-29-23-17)20(16(13)12-22)25-30(27,28)19-10-6-7-14-15(19)8-5-9-18(14)26(2)3/h5-11,25H,4H2,1-3H3