(4E)-N-(3-imidazol-1-ylpropyl)-3-methyl-4-(phenylsulfonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxamide

Systemtic Name: (4E)-N-(3-imidazol-1-ylpropyl)-3-methyl-4-(phenylsulfonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxamide Openeye Name: (4E)-4-(benzenesulfonylhydrazono)-N-(3-imidazol-1-ylpropyl)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide CAS Name: (4E)-4-(benzenesulfonylhydrazinylidene)-N-[3-(1-imidazolyl)propyl]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide IUPAC Name: (4E)-4-(benzenesulfonylhydrazinylidene)-N-(3-imidazol-1-ylpropyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxamide Traditional Name: (4E)-4-(besylhydrazono)-N-(3-imidazol-1-ylpropyl)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNS(=O)(=O)C3=CC=CC=C3)CCC2)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NS(=O)(=O)C3=CC=CC=C3)/CCC2)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C22H25N5O4S/c1-16-20-18(25-26-32(29,30)17-7-3-2-4-8-17)9-5-10-19(20)31-21(16)22(28)24-11-6-13-27-14-12-23-15-27/h2-4,7-8,12,14-15,26H,5-6,9-11,13H2,1H3,(H,24,28)/b25-18+