4-fluoranyl-N-[(E)-[3-methyl-2-(4-phenylpiperazin-1-yl)carbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[(E)-[3-methyl-2-(4-phenylpiperazin-1-yl)carbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzenesulfonamide Openeye Name: 4-fluoro-N-[(E)-[3-methyl-2-(4-phenylpiperazine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzenesulfonamide CAS Name: 4-fluoro-N-[(E)-[3-methyl-2-[oxo-(4-phenyl-1-piperazinyl)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzenesulfonamide IUPAC Name: 4-fluoro-N-[(E)-[3-methyl-2-(4-phenylpiperazine-1-carbonyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzenesulfonamide Traditional Name: 4-fluoro-N-[(E)-[3-methyl-2-(4-phenylpiperazine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzenesulfonamide Formula: C26H27FN4O4S MolecularWeight: 510.580383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNS(=O)(=O)C3=CC=C(C=C3)F)CCC2)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NS(=O)(=O)C3=CC=C(C=C3)F)/CCC2)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H27FN4O4S/c1-18-24-22(28-29-36(33,34)21-12-10-19(27)11-13-21)8-5-9-23(24)35-25(18)26(32)31-16-14-30(15-17-31)20-6-3-2-4-7-20/h2-4,6-7,10-13,29H,5,8-9,14-17H2,1H3/b28-22+