N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methoxy-phenyl]carbamothioyl]-4-fluoranyl-benzamide

Systemtic Name: N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methoxy-phenyl]carbamothioyl]-4-fluoranyl-benzamide Openeye Name: N-[[4-(1,3-dioxoisoindolin-2-yl)-3-methoxy-phenyl]carbamothioyl]-4-fluoro-benzamide CAS Name: N-[[4-(1,3-dioxo-2-isoindolyl)-3-methoxyanilino]-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: N-[[4-(1,3-dioxoisoindol-2-yl)-3-methoxyphenyl]carbamothioyl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-[(3-methoxy-4-phthalimido-phenyl)thiocarbamoyl]benzamide Formula: C23H16FN3O4S MolecularWeight: 449.454243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H16FN3O4S/c1-31-19-12-15(25-23(32)26-20(28)13-6-8-14(24)9-7-13)10-11-18(19)27-21(29)16-4-2-3-5-17(16)22(27)30/h2-12H,1H3,(H2,25,26,28,32)